(Z)-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3-phenylprop-2-enamide

HCID 2298640

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Basic information

CAS: 5837-43-4
Standard SMILES: O=C(/C=C\c1ccccc1)Nc1cccc(-c2nc3cc(Cl)ccc3o2)c1
InChIKey: IBSLBRMCKJXOEE-XFXZXTDPSA-N
Molecular formula: C22H15ClN2O2
Average molar mass: 374.8 g/mol
Monoisotopic mass: 374.0822054

Names & identifiers

Preferred name: (Z)-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3-phenylprop-2-enamide
IUPAC: (Z)-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3-phenylprop-2-enamide

Names & synonyms

5837-43-4(Z)-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3-phenylprop-2-enamideN-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3-phenylacrylamideAC1M59QZDTXSID40367841(2Z)-N-[3-(5-CHLORO-1,3-BENZOXAZOL-2-YL)PHENYL]-3-PHENYLPROP-2-ENAMIDE

Database identifiers

CAS: 5837-43-4
PubChem CID: 2298640
DTXSID: DTXSID40367841

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 55.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 27
Formal charge: 0
Complexity: 534

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