N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]thiophene-2-carboxamide

Formula:C14H11N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]thiophene-2-carboxamide is a drug-like molecule.

MolName	N-[(Z)-[(E)-3-(2-nitrophenyl)prop-2-enylidene]amino]thiophene-2-carboxamide
MolecularFormula	C14H11N3O3S
Smiles	[O-][N+](c1c(/C=C/C=N\NC(c2cccs2)=O)cccc1)=O
InChI	InChI=1S/C14H11N3O3S/c18-14(13-8-4-10-21-13)16-15-9-3-6-11-5-1-2-7-12(11)17(19)20/h1-10H,(H,16,18)
InChIK	APNMOOQPFHLKOS-UHFFFAOYSA-N
TotalMolweight	301.325
Molweight	301.325
MonoisotopicMass	301.052112
CLogP	2.1649
CLogS	-4.483
H Acceptors	6
H Donors	1
TotalSurfaceArea	233.1
Relative PSA	0.37233
PolarSurfaceArea	115.52
Druglikeness	1.1026
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.61905
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
AcidicOxygens	1
StereoCon

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