N-[(Z)-3-[(2-chlorophenyl)methylamino]-1-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-3-oxoprop-1-en-2-yl]benzamide

Formula:C32H24N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-[(2-chlorophenyl)methylamino]-1-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-3-[(2-chlorophenyl)methylamino]-1-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C32H24N4O2Cl2
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1cn(-c2ccccc2)nc1-c(cc1)ccc1Cl)NCc(cccc1)c1Cl
InChI	InChI=1S/C32H24Cl2N4O2/c33-26-17-15-22(16-18-26)30-25(21-38(37-30)27-12-5-2-6-13-27)19-29(36-31(39)23-9-3-1-4-10-23)32(40)35-20-24-11-7-8-14-28(24)34/h1-19,21H,20H2,(H,35,40)(H,36,39)
InChIK	OYYWWWCLHWAMMC-UHFFFAOYSA-N
TotalMolweight	567.475
Molweight	567.475
MonoisotopicMass	566.12763
CLogP	6.2642
CLogS	-7.674
H Acceptors	6
H Donors	2
TotalSurfaceArea	427.99
Relative PSA	0.15617
PolarSurfaceArea	76.02
Druglikeness	5.6963
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.4
Fragments	1
Non HAtoms	40
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	29
Sp3Atoms	1
Symmetricatoms	6
Amides	2
Aromatic Nitrogens	2
StereoCon

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1 - N-[(Z)-3-[(2-chlorophenyl)methylamino]-1-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(Z)-3-[(2-chlorophenyl)methylamino]-1-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-3-oxoprop-1-en-2-yl]benzamide

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