MW: 345.53

CAS: 6879-74-9

TNP NUMBER: TNP00617

MDL NUMBER: MFCD00274559

IUPAC: 8-[(1E)-2-((2S,6R)-1,6-dimethyl(2-piperidyl))vinyl](3S,6S,9S,1R,7R,8R)-6-methy l-5-oxatricyclo[7.4.0.0<3,7>]tridecan-4-one

Smiles: C1C[C@@H]2([C@H]([C@@H]3[C@H](C[C@H]2CC1)C(=O)O[C@H]3C)\C=C\[C@H]1N([C@@H](CCC1)C)C)

Himbacine is an alkaloid isolated from Galbulimima baccata. It is a potent muscarinic M2/M4 receptor antagonist1,2

REFERENCE: Doller, D., et al., Design, synthesis, and structure-activity relationship studies of himbacine derived muscarinic receptor antagonists. Bioorg. Med. Chem. Lett. 9, 901-906, (1999) abstract Sagrada, A., et al., Himbacine discriminates between putative muscarinic M1 receptor-mediated responses. Life Sci. 54, PL305-PL310, (1994) abstract Miller, J.H., et al., Binding and functional selectivity of himbacine for cloned and neuronal muscarinic receptors. J. Pharmacol. Exp. Ther. 263, 663-667, (1992) abstract Dorje, F., et al., Antagonist binding profiles of five cloned human muscarinic receptor subtypes. J. Pharmacol. Exp. Ther. 256, 727-733, (1991) abstract

SOURCE: Himbacine is an alkaloid isolated from Galbulimima baccata.

ACCEPTORS: 2

DONORS: 0

ROTATION BONDS: 0

N+O: 3

Chiral Centers: 8

LogP: 7.32

LogS: -5.92

LIPINSKI: 3

MW: 181.66

CAS: 200-468-8, 60-31-1

MDL NUMBER: MFCD00011698

IUPAC: 2-(trimethylamino)ethyl acetate, chloride

Smiles: CC(OCC[N+](C)(C)C)=O.[Cl-]

THERAPEUTIC CATEGORY: Cholinergic

ACCEPTORS: 2

DONORS: 0

ROTATION BONDS: 3

N+O: 3

Chiral Centers: 0

LogP: 2.04

LogS: -2.88

LIPINSKI: 4

Synonyms: (2-Hydroxyethyl)trimethylammoniumchlorideacetate;2-(acetyloxy)-n,n,n-trimethyl-ethanaminiuchloride;acecholin;acetylcholinehydrochloride;acetylcholiniumchloride;achchloride;ammonium,(2-hydroxyethyl)trimethyl-,chloride,acetate;arterocoline

CAS:60-31-1

MF:C7H16ClNO2

MW:181.66

EINECS:200-468-8

Product Categories:Ammonium Chlorides (Quaternary);Quaternary Ammonium Compounds Acetylcholine chloride

Chemical Properties: mp 146-150 C(lit.) storage temp. 0-6C solubility H2O: 0.1 g/mL, clear, colorless Water Solubility Soluble IN COLD WATER Sensitive Hygroscopic Merck 14,87 BRN 3571875 Stability:Stable. Substances to be avoided include strong oxidizing agents. Protect from moisture - very hygroscopic.

CAS DataBase Reference: 60-31-1(

CAS DataBase Reference: ) EPA Substance Registry SystemEthanaminium, 2-(acetyloxy)-N,N,N-trimethyl-, chloride(60-31-1) Xi Risk Statements 36/37/38 Safety Statements 26-37/39-36 WGK Germany 2 RTECS FZ9800000 F 3-8-10-21 Acetylcholine chloride

Usage And Synthesis:

Chemical Properties: White crystalline powder Biological ActivityEndogenous neurotransmitter. Acts at nicotinic and muscarinic acetylcholine receptors. Acetylcholine chloride

MW: 212.17

CAS: 25371-96-4

MDL NUMBER: MFCD00041206

IUPAC: [2-(trifluoromethyl)phenyl]imidazole

Smiles: c1(n2cncc2)ccccc1C(F)(F)F

ACCEPTORS: 0

DONORS: 0

ROTATION BONDS: 0

N+O: 2

Chiral Centers: 0

LogP: 2.72

LogS: -3.6

LIPINSKI: 4

Synonyms: I-(2-TRIFLUOROMETHYLPHENYL)IMIDAZOLE;1-(ALPHA,ALPHA,ALPHA-TRIFLUORO-O-TOLYL)-IMIDAZOLE;1-(2-TRIFLUOROMETHYLPHENYL)IMIDAZOLE;1-[2-(TRIFLUOROMETHYL)PHENYL]-1H-IMIDAZOLE;TRIM;1-[2-(Trifluoromethyl)phenyl]-1H-imidazole 98%;1-[2-(Trifluoromethyl)phenyl]-1H-imidazole98%;1-(2-Trifluoromethylphenyl)imidazole, 98+%

CAS:25371-96-4

MF:C10H7F3N2

MW:212.17

EINECS:-0

Product Categories:Imidazol&Benzimidazole 1-(2-TRIFLUOROMETHYLPHENYL)IMIDAZOLE

Chemical Properties: mp 43 C bp 75C 0,02mm Fp 75C/0.025mm storage temp. 2-8C Sensitive Light Sensitive BRN 3955637

CAS DataBase Reference: 25371-96-4(

CAS DataBase Reference: ) Xi Risk Statements 36/37/38 Safety Statements 26-36 WGK Germany 3 Hazard Note Irritant HazardClass IRRITANT, LIGHT SENSITIVE 1-(2-TRIFLUOROMETHYLPHENYL)IMIDAZOLE

Usage And Synthesis: Biological ActivityA potent inhibitor of neuronal and inducible NO synthases, with much lower affinity for the endothelial isoform (displays IC 50 values of 28.2, 27.0 and 1057.5 u M respectively). Antinociceptive in vivo . 1-(2-TRIFLUOROMETHYLPHENYL)IMIDAZOLE

MW: 163.26

Salt: 0.5H2SO4

CAS: 1212-72-2

MDL NUMBER: MFCD00130069

IUPAC: (1,1-dimethyl-2-phenylethyl)methylamine

Smiles: c1ccc(cc1)CC(NC)(C)C

THERAPEUTIC CATEGORY: Antihypotensive

ACCEPTORS: 0

DONORS: 1

ROTATION BONDS: 2

N+O: 1

Chiral Centers: 0

LogP: 3.07

LogS: -3.67

LIPINSKI: 4

Synonyms: MEPHENTERMINE HEMISULFATE SALT;N,ALPHA,ALPHA-TRIMETHYLPHENETHYLAMINE;N,ALPHA,ALPHA-TRIMETHYLPHENETHYLAMINE HEMISULFATE SALT;mephenterminesulfate;mephenterminesulphate;n,alpha,alpha-trimethyl-benzeneethanaminsulfate(2:1);n,alpha,alpha-trimethyl-phenethylaminsulfate(2:1);wyaminer

CAS:1212-72-2

MF:C22H36N2O4S

MW:424.6

EINECS:214-923-3

Product Categories: MEPHENTERMINE HEMISULFATE SALT Hazard Codes T Risk Statements 25 Safety Statements 45 RIDADR UN 2811 6.1/PG 3 WGK Germany 3 RTECS SI4030000 MEPHENTERMINE HEMISULFATE SALT

Usage And Synthesis: MEPHENTERMINE HEMISULFATE SALT