2-[(Z)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]isoindole-1,3-dione

Formula:C26H16N4O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(Z)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]isoindole-1,3-dione is a drug-like molecule.

MolName	2-[(Z)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]isoindole-1,3-dione
MolecularFormula	C26H16N4O3
Smiles	O=C(c(cccc1)c1C1=O)N1/N=C\c1cn(-c2ccccc2)nc1-c1cc(cccc2)c2o1
InChI	InChI=1S/C26H16N4O3/c31-25-20-11-5-6-12-21(20)26(32)30(25)27-15-18-16-29(19-9-2-1-3-10-19)28-24(18)23-14-17-8-4-7-13-22(17)33-23/h1-16H
InChIK	CLXSHNBQCKUWRT-UHFFFAOYSA-N
TotalMolweight	432.438
Molweight	432.438
MonoisotopicMass	432.122241
CLogP	4.1133
CLogS	-5.946
H Acceptors	7
TotalSurfaceArea	321.85
Relative PSA	0.22709
PolarSurfaceArea	80.7
Druglikeness	4.312
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.42424
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	26
Symmetricatoms	7
Aromatic Nitrogens	2
StereoCon

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