N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]furan-2-carboxamide

HCID 5908036

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Basic information

CAS: 339208-12-7
Standard SMILES: C/C(=N/NC(=O)CNC(=O)c1ccco1)c1ccc(Cl)cc1
InChIKey: BHTGUURNOJHSPL-ZDLGFXPLSA-N
Molecular formula: C15H14ClN3O3
Average molar mass: 319.74 g/mol
Monoisotopic mass: 319.072369

Names & identifiers

Preferred name: N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]furan-2-carboxamide
IUPAC: N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]furan-2-carboxamide

Names & synonyms

N-[2-[(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-2-oxoethyl]furan-2-carboxamideN-(2-{(2Z)-2-[1-(4-Chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)furan-2-carboxamideMLS001075935CHEMBL3194975DTXSID901330592AKOS030509022339208-12-7SMR000646114(Z)-N-(2-(2-(1-(4-chlorophenyl)ethylidene)hydrazinyl)-2-oxoethyl)furan-2-carboxamide

Database identifiers

CAS: 339208-12-7
PubChem CID: 5908036
DTXSID: DTXSID901330592
ChEMBL: CHEMBL3194975

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 83.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 5
Heavy atoms: 22
Formal charge: 0
Complexity: 434

Experimental & physicochemical properties

Solubility28.9 [ug/mL] (The mean of the results at pH 7.4)

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