BRN 4602007

ethyl 4-[[3-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoyl]amino]benzoate

CAS: 88351-74-0

Molecular Formula	`C24H21N3O3S2`
Molecular Weight	463.6 g/mol
LogP	5.3
Topological Polar Surface Area	128.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	463.10245
Heavy Atoms	32
Complexity	683.0

Chemical Identifiers

CAS Number	88351-74-0
SMILES	`CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)NCN3C4=CC=CC=C4SC3=S`
InChIKey	`FACSESZSPKMHEI-UHFFFAOYSA-N`

📖 Product Overview

BRN 4602007 (CAS: 88351-74-0) is a chemical compound with molecular formula C24H21N3O3S2 and molecular weight 463.6 g/mol. Its IUPAC systematic name is ethyl 4-[[3-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoyl]amino]benzoate. LogP 5.3 Topological Polar Surface Area 128.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 8 Exact Mass 463.10245 Heavy Atoms 32 Complexity 683.0 InChI Key: FACSESZSPKMHEI-UHFFFAOYSA-N. SMILES: CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)NCN3C4=CC=CC=C4SC3=S.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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