RefChem:326207

3-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid;hydrochloride

Also Known As: Benzo(b)thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-3-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-, hydrochloride|3-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid hydrochloride|3-[2-hydroxy-3-(propan-2-ylamino)propoxy]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid,hydrochloride|3-{2-Hydroxy-3-[(propan-2-yl)amino]propoxy}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid--hydrogen chloride (1/1)

Molecular Formula	C15H24ClNO4S
Molecular Weight	349.11145 g/mol
LogP	2.4846
Topological Polar Surface Area	78.79 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	349.11145
Monoisotopic Mass	349.11145
Heavy Atoms	22
Complexity	503.97705

Chemical Identifiers

CAS Number	85462-85-7
SMILES	CC(C)NCC(COC1=C(SC2=C1CCCC2)C(=O)O)O.Cl