Zilpaterol hydrochloride
Properties
- Molecular formula
- C14H20ClN3O2
- Molar mass
- 297.78 g/mol
- Exact mass
- 297.1244 Da
- logP
- 1.56Crippen estimate
- Polar surface area
- 70.0 Ų
- H-bond donors / acceptors
- 3 / 3
- Rotatable bonds
- 2
- Stereocentres
- S, Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
119520-06-8SMILES
CC(C)N[C@H]1CCN2C(=O)NC3=CC=CC(=C32)[C@@H]1O.ClInChIKey
GIEFXLLRTJNFGT-JZKFLRDJSA-NInChI
InChI=1S/C14H19N3O2.ClH/c1-8(2)15-11-6-7-17-12-9(13(11)18)4-3-5-10(12)16-14(17)19;/h3-5,8,11,13,15,18H,6-7H2,1-2H3,(H,16,19);1H/t11-,13-;/m0./s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, hydrochloride (1:1), (6R,7R)-rel-
- Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, monohydrochloride, trans-
- Imidazo[4,5,1-jk][1]benzazepin-2(1H)-one, 4,5,6,7-tetrahydro-7-hydroxy-6-[(1-methylethyl)amino]-, monohydrochloride, (6R,7R)-rel-
- Zilmax
- trans-(±)-Zilpaterol hydrochloride
Work with Zilpaterol hydrochloride
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
7-Amino-6-hydroxy-6,7,8,9-tetrahydro-2,9a-diazabenzo[cd]azulen-1(2H)-one hydrochloride1021910-71-367 % similar
Procaterol hydrochloride62929-91-339 % similar
4,5-Dihydro-6-oxime-imidazo[4,5,1-jk][1]benzazepine-2,6,7(1H)-trione92260-82-736 % similar
5,6-Dihydroimidazo(4,5,1-jk)(1)benzazepine-2,7(1h,4h)-dione92260-81-635 % similar
Procaterol72332-33-334 % similar
N-[2-(2-Chlorophenyl)-2-hydroxyethyl]propan-2-aminium chloride6933-90-032 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.