(3Z)-3-[(4-chlorophenyl)methylidene]-1,4,5-triphenyl-4H-pyrrolo[3,4-b]pyrrole-2,6-dione

Formula:C31H21N2O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (3Z)-3-[(4-chlorophenyl)methylidene]-1,4,5-triphenyl-4H-pyrrolo[3,4-b]pyrrole-2,6-dione is not a drug-like molecule.

MolName	(3Z)-3-[(4-chlorophenyl)methylidene]-1,4,5-triphenyl-4H-pyrrolo[3,4-b]pyrrole-2,6-dione
MolecularFormula	C31H21N2O2Cl
Smiles	O=C(/C(/C(C(c1ccccc1)N1c2ccccc2)=C2C1=O)=C\c(cc1)ccc1Cl)N2c1ccccc1
InChI	InChI=1S/C31H21ClN2O2/c32-23-18-16-21(17-19-23)20-26-27-28(22-10-4-1-5-11-22)33(24-12-6-2-7-13-24)31(36)29(27)34(30(26)35)25-14-8-3-9-15-25/h1-20,28H/t28-/m1/s1
InChIK	QPSAUERDHXFMQJ-MUUNZHRXSA-N
TotalMolweight	488.973
Molweight	488.973
MonoisotopicMass	488.129155
CLogP	6.2188
CLogS	-6.944
H Acceptors	4
TotalSurfaceArea	357.19
Relative PSA	0.092892
PolarSurfaceArea	40.62
Druglikeness	3.9699
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.38889
Fragments	1
Non HAtoms	36
NonCHAtoms	5
Electronegative Atoms	5
StereoCenters	1
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	1
Symmetricatoms	8
Amides	2
StereoCon	racemate

Click to Load Molecule:

1 - (3Z)-3-[(4-chlorophenyl)methylidene]-1,4,5-triphenyl-4H-pyrrolo[3,4-b]pyrrole-2,6-dione | 2 - (3Z)-3-[(4-chlorophenyl)methylidene]-1,4,5-triphenyl-4H-pyrrolo[3,4-b]pyrrole-2,6-dione

Request More Details | (3Z)-3-[(4-chlorophenyl)methylidene]-1,4,5-triphenyl-4H-pyrrolo[3,4-b]pyrrole-2,6-dione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments