Compound C14H19ClN2OS

7-chloro-1-[3-(dimethylamino)propyl]-5H-4,1-benzothiazepin-2-one

CAS: 13540-16-4

Molecular Formula	`C14H19ClN2OS`
Molecular Weight	298.8 g/mol
LogP	2.6
Topological Polar Surface Area	48.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	4
Exact Mass	298.09067
Heavy Atoms	19
Complexity	314.0

Chemical Identifiers

CAS Number	13540-16-4
SMILES	`CN(C)CCCN1C(=O)CSCC2=C1C=CC(=C2)Cl`
InChIKey	`OCECEZMMPHZBCP-UHFFFAOYSA-N`

📖 Product Overview

Compound C14H19ClN2OS (CAS: 13540-16-4) is a chemical compound with molecular formula C14H19ClN2OS and molecular weight 298.8 g/mol. Its IUPAC systematic name is 7-chloro-1-[3-(dimethylamino)propyl]-5H-4,1-benzothiazepin-2-one. LogP 2.6 Topological Polar Surface Area 48.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 4 Exact Mass 298.09067 Heavy Atoms 19 Complexity 314.0 InChI Key: OCECEZMMPHZBCP-UHFFFAOYSA-N. SMILES: CN(C)CCCN1C(=O)CSCC2=C1C=CC(=C2)Cl.

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