3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-benzofuran-2-carboxamide

Formula:C18H13N3O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-benzofuran-2-carboxamide is a drug-like molecule.

MolName	3-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-1-benzofuran-2-carboxamide
MolecularFormula	C18H13N3O5
Smiles	NC(c(oc1c2cccc1)c2NC(/C=C/c1cccc([N+]([O-])=O)c1)=O)=O
InChI	InChI=1S/C18H13N3O5/c19-18(23)17-16(13-6-1-2-7-14(13)26-17)20-15(22)9-8-11-4-3-5-12(10-11)21(24)25/h1-10H,(H2,19,23)(H,20,22)
InChIK	OYTFFRBEJSEPRQ-UHFFFAOYSA-N
TotalMolweight	351.317
Molweight	351.317
MonoisotopicMass	351.085522
CLogP	1.8076
CLogS	-5.23
H Acceptors	8
H Donors	2
TotalSurfaceArea	262.96
Relative PSA	0.37017
PolarSurfaceArea	131.15
Druglikeness	-3.73
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	1
Amides	2
AcidicOxygens	1
StereoCon

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