(E)-N-(2-chloro-4-nitrophenyl)-3-(2-nitrophenyl)prop-2-enamide

Formula:C15H10N3O5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(2-chloro-4-nitrophenyl)-3-(2-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-(2-chloro-4-nitrophenyl)-3-(2-nitrophenyl)prop-2-enamide
MolecularFormula	C15H10N3O5Cl
Smiles	[O-][N+](c(cc1)cc(Cl)c1NC(/C=C/c(cccc1)c1[N+]([O-])=O)=O)=O
InChI	InChI=1S/C15H10ClN3O5/c16-12-9-11(18(21)22)6-7-13(12)17-15(20)8-5-10-3-1-2-4-14(10)19(23)24/h1-9H,(H,17,20)
InChIK	ORMCCIVMFDZLQH-UHFFFAOYSA-N
TotalMolweight	347.713
Molweight	347.713
MonoisotopicMass	347.030899
CLogP	1.8991
CLogS	-5.154
H Acceptors	8
H Donors	1
TotalSurfaceArea	251.49
Relative PSA	0.33934
PolarSurfaceArea	120.74
Druglikeness	-5.4509
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	aromatic nitro
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Amides	1
AcidicOxygens	2
StereoCon

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