N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide

Formula:C18H14N4O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide is a drug-like molecule.

MolName	N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-phenyl-1H-pyrazole-5-carboxamide
MolecularFormula	C18H14N4O3
Smiles	O=C(c1cc(-c2ccccc2)n[nH]1)N/N=C\c(cc1)cc2c1OCO2
InChI	InChI=1S/C18H14N4O3/c23-18(15-9-14(20-21-15)13-4-2-1-3-5-13)22-19-10-12-6-7-16-17(8-12)25-11-24-16/h1-10H,11H2,(H,20,21)(H,22,23)
InChIK	LHDNPUFZTLYZMT-UHFFFAOYSA-N
TotalMolweight	334.334
Molweight	334.334
MonoisotopicMass	334.106591
CLogP	3.0108
CLogS	-4.807
H Acceptors	7
H Donors	2
TotalSurfaceArea	255.34
Relative PSA	0.31711
PolarSurfaceArea	88.6
Druglikeness	5.4954
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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