N-[(E)-[3-(1H-benzimidazol-2-yl)chromen-2-ylidene]amino]-3-nitrobenzamide

Formula:C23H15N5O4 Mutagenic:none Tumorigenic:none Reproductive Effective:low N-[(E)-[3-(1H-benzimidazol-2-yl)chromen-2-ylidene]amino]-3-nitrobenzamide is a drug-like molecule.

MolName	N-[(E)-[3-(1H-benzimidazol-2-yl)chromen-2-ylidene]amino]-3-nitrobenzamide
MolecularFormula	C23H15N5O4
Smiles	[O-][N+](c1cc(C(N/N=C2/Oc(cccc3)c3C=C2c2nc(cccc3)c3[nH]2)=O)ccc1)=O
InChI	InChI=1S/C23H15N5O4/c29-22(15-7-5-8-16(12-15)28(30)31)26-27-23-17(13-14-6-1-4-11-20(14)32-23)21-24-18-9-2-3-10-19(18)25-21/h1-13H,(H,24,25)(H,26,29)
InChIK	UECYOJKFWPLXRQ-UHFFFAOYSA-N
TotalMolweight	425.403
Molweight	425.403
MonoisotopicMass	425.112405
CLogP	2.7584
CLogS	-5.063
H Acceptors	9
H Donors	2
TotalSurfaceArea	312.77
Relative PSA	0.32417
PolarSurfaceArea	125.19
Druglikeness	-1.2312
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone
Shape Index	0.46875
Fragments	1
Non HAtoms	32
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Aromatic Nitrogens	2
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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