AC1NBX8A

ethyl 2-[2-(3-phenylsulfanylpropanoylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate

Also Known As: F1366-5062|(Z)-ethyl 2-(2-((3-(phenylthio)propanoyl)imino)-6-sulfamoylbenzo[d]thiazol-3(2H)-yl)acetate|ethyl 2-[(2Z)-2-{[3-(phenylsulfanyl)propanoyl]imino}-6-sulfamoyl-2,3-dihydro-1,3-benzothiazol-3-yl]acetate|ethyl 2-[2-(3-phenylsulfanylpropanoylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate|Ethyl 2-[2-(3-phenylsulfanylpropanoylimino)-6-sulfamoyl-benzothiazol-3-yl]acetate

Molecular Formula	C20H21N3O5S3
Molecular Weight	479.06433 g/mol
LogP	2.523
Topological Polar Surface Area	120.82 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	479.06433
Monoisotopic Mass	479.06433
Heavy Atoms	31
Complexity	1264.2025

Chemical Identifiers

CAS Number	865249-21-4
SMILES	CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)CCSC3=CC=CC=C3