4,5,6,7-Tetrahydrothieno[2,3-c]pyridine Hydrochloride - CAS 28783-38-2

Catalog:	BB076770
Product Name:	4,5,6,7-Tetrahydrothieno[2,3-c]pyridine Hydrochloride
CAS:	28783-38-2
Synonyms:	4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDINE HYDROCHLORIDE; 4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDINE HCL; 4H,5H,6H,7H-thieno[2,3-c]pyridine hydrochloride; 4,5,6,7-tetrahydrothieno[2,3-c]pyridinehydrochloride; 4,5,6,7-tetrahydrothieno[2,3-c]pyridine; hydrochloride; 4,5,6,7-Tetrahydrothieno[2,3-c]pyridine, HCl

Technical Data

IUPAC Name:	4,5,6,7-tetrahydrothieno[2,3-c]pyridinehydrochloride
Description:	Used for preparation of thieno-tetrahydropyridines useful as class III antiarrhythmic agents.
Molecular Weight:	175.68
Molecular Formula:	C7H10ClNS
Canonical SMILES:	C1CNCC2=C1C=CS2.Cl
InChI:	InChI=1S/C7H9NS.ClH/c1-3-8-5-7-6(1)2-4-9-7/h2,4,8H,1,3,5H21H
InChI Key:	VQEOIFRMJGFLQH-UHFFFAOYSA-N
Melting Point:	>140°C (dec.)
Solubility:	DMSO, Methanol
Appearance:	White Solid
Storage:	Refrigerator
References:	Bahekar, R., et al. Bioorg. Med. Chem., 15, 5950 (2007), Hayakawa, M., et al. Bioorg. Med. Chem. Lett., 17, 2438 (2007),.

Complexity:	105
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	175.0222482
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	175.0222482
Rotatable Bond Count:	0
Topological Polar Surface Area:	40.3Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0