(E)-N-[1-(5-Acetyl-furan-2-ylmethyl)-1H-pyrazol-4-yl]-3-(3-chloro-phenyl)-acrylamide

HCID 42646540
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Basic information

Standard SMILES
CC(=O)c1ccc(Cn2cc(NC(=O)/C=C/c3cccc(Cl)c3)cn2)o1
InChIKey
QSOCZRBSDYQDQR-VMPITWQZSA-N
Molecular formula
C19H16ClN3O3
Average molar mass
369.8 g/mol
Monoisotopic mass
369.0880191

Names & identifiers

Preferred name
(E)-N-[1-(5-Acetyl-furan-2-ylmethyl)-1H-pyrazol-4-yl]-3-(3-chloro-phenyl)-acrylamide
IUPAC
(E)-N-[1-[(5-acetylfuran-2-yl)methyl]pyrazol-4-yl]-3-(3-chlorophenyl)prop-2-enamide

Names & synonyms

SCHEMBL1168047QSOCZRBSDYQDQR-VMPITWQZSA-N(E)-N-[1-(5-Acetyl-furan-2-ylmethyl)-1H-pyrazol-4-yl]-3-(3-chloro-phenyl)-acrylamide

Database identifiers

PubChem CID
42646540

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
77.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
26

Related reactions

1 records
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Compound notes

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