AC1LD1RT

HCID 610554

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Basic information

CAS: 5644-62-2
Standard SMILES: NS(=O)(=O)c1ccc2nc(NC(=O)c3ccc(C(=O)c4ccccc4)cc3)sc2c1
InChIKey: POIHGUKUVAOCKV-UHFFFAOYSA-N
Molecular formula: C21H15N3O4S2
Average molar mass: 437.5 g/mol
Monoisotopic mass: 437.05039832

Names & identifiers

Preferred name: AC1LD1RT
IUPAC: 4-benzoyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamide

Names & synonyms

AC1LD1RTDTXSID803462315644-62-2RefChem:313897DTXCID70297304N-(6-Aminosulfonyl-2-benzothiazolyl)-4-benzoylbenzamide4-benzoyl-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)benzamidePOIHGUKUVAOCKV-UHFFFAOYSA-NN-[6-(Aminosulfonyl)-1,3-benzothiazol-2-yl]-4-benzoylbenzamide #

Database identifiers

CAS: 5644-62-2
PubChem CID: 610554
DTXSID: DTXSID80346231

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 156 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 5
Heavy atoms: 30
Formal charge: 0
Complexity: 740

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