Arotinolol hydrochloride
Properties
- Molecular formula
- C15H22ClN3O2S3
- Molar mass
- 407.99 g/mol
- Exact mass
- 407.0563 Da
- Melting point
- 234–235.5 °C
- logP
- 3.23Crippen estimate
- Polar surface area
- 88.2 Ų
- H-bond donors / acceptors
- 3 / 7
- Rotatable bonds
- 7
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
68377-91-3SMILES
CC(C)(C)NCC(O)CSc1nc(-c2ccc(C(N)=O)s2)cs1.ClInChIKey
XXDAXBZYUXLDRD-UHFFFAOYSA-NInChI
InChI=1S/C15H21N3O2S3.ClH/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20;/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20);1HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 2-Thiophenecarboxamide, 5-[2-[[3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl]thio]-4-thiazolyl]-, hydrochloride (1:1)
- 2-Thiophenecarboxamide, 5-[2-[[3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl]thio]-4-thiazolyl]-, monohydrochloride, (±)-
- 2-Thiophenecarboxamide, 5-[2-[[3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl]thio]-4-thiazolyl]-, monohydrochloride
- S 596
- ARL
- Almarl
Work with Arotinolol 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
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds