3-(4-chlorophenyl)-N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1H-pyrazole-5-carboxamide

Formula:C19H14N4OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-(4-chlorophenyl)-N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1H-pyrazole-5-carboxamide is a drug-like molecule.

MolName	3-(4-chlorophenyl)-N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-1H-pyrazole-5-carboxamide
MolecularFormula	C19H14N4OCl2
Smiles	O=C(c1cc(-c(cc2)ccc2Cl)n[nH]1)N/N=C\C(\Cl)=C\c1ccccc1
InChI	InChI=1S/C19H14Cl2N4O/c20-15-8-6-14(7-9-15)17-11-18(24-23-17)19(26)25-22-12-16(21)10-13-4-2-1-3-5-13/h1-12H,(H,23,24)(H,25,26)
InChIK	CACUICJTSFPSGK-UHFFFAOYSA-N
TotalMolweight	385.253
Molweight	385.253
MonoisotopicMass	384.054465
CLogP	3.9853
CLogS	-5.815
H Acceptors	5
H Donors	2
TotalSurfaceArea	290.63
Relative PSA	0.20979
PolarSurfaceArea	70.14
Druglikeness	5.6343
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.69231
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

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