3-chloro-N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide

Formula:C30H20N3OClS Mutagenic:high Tumorigenic:none Reproductive Effective:high 3-chloro-N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide is not a drug-like molecule.

MolName	3-chloro-N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide
MolecularFormula	C30H20N3OClS
Smiles	O=C(c(sc1c2cccc1)c2Cl)N/N=C\c(c1c2cccc1)c(-c1ccccc1)n2-c1ccccc1
InChI	InChI=1S/C30H20ClN3OS/c31-27-23-16-8-10-18-26(23)36-29(27)30(35)33-32-19-24-22-15-7-9-17-25(22)34(21-13-5-2-6-14-21)28(24)20-11-3-1-4-12-20/h1-19H,(H,33,35)
InChIK	OOANHBXARIXDAX-UHFFFAOYSA-N
TotalMolweight	506.028
Molweight	506.028
MonoisotopicMass	505.101559
CLogP	7.9808
CLogS	-11.398
H Acceptors	4
H Donors	1
TotalSurfaceArea	376.27
Relative PSA	0.16807
PolarSurfaceArea	74.63
Druglikeness	6.4575
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; 3-halo-enone
Shape Index	0.44444
Fragments	1
Non HAtoms	36
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	6
Small Rings	6
Aromatic Rings	6
Aromatic Atoms	30
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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