(1R)-1-(3-phenoxyphenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

Formula:C28H18N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (1R)-1-(3-phenoxyphenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is a drug-like molecule.

MolName(1R)-1-(3-phenoxyphenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
MolecularFormulaC28H18N2O4
SmilesO=C(C(Oc1c2cccc1)=C([C@H]1c3cc(Oc4ccccc4)ccc3)C2=O)N1c1ncccc1
InChIInChI=1S/C28H18N2O4/c31-26-21-13-4-5-14-22(21)34-27-24(26)25(30(28(27)32)23-15-6-7-16-29-23)18-9-8-12-20(17-18)33-19-10-2-1-3-11-19/h1-17,25H/t25-/m1/s1
InChIKNDXOVLVPXAWXLZ-RUZDIDTESA-N
TotalMolweight446.461
Molweight446.461
MonoisotopicMass446.126658
CLogP4.7039
CLogS-6.955
H Acceptors6
TotalSurfaceArea325.52
Relative PSA0.18616
PolarSurfaceArea68.73
Druglikeness2.6612
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.44118
Fragments1
Non HAtoms34
NonCHAtoms6
Electronegative Atoms6
StereoCenters1
Rotatable Bond4
Rings Closures6
Small Rings6
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms3
Symmetricatoms2
Amides1
Aromatic Nitrogens1
StereoConthis enantiomer

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