4-chloro-3-[(4-chlorophenyl)sulfamoyl]-N-[(Z)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzamide

Formula:C28H21N3O4Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-chloro-3-[(4-chlorophenyl)sulfamoyl]-N-[(Z)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzamide is not a drug-like molecule.

MolName4-chloro-3-[(4-chlorophenyl)sulfamoyl]-N-[(Z)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzamide
MolecularFormulaC28H21N3O4Cl2S
SmilesO=C(c(cc1)cc(S(Nc(cc2)ccc2Cl)(=O)=O)c1Cl)N/N=C(/C1)\c(cccc2)c2OC1c1ccccc1
InChIInChI=1S/C28H21Cl2N3O4S/c29-20-11-13-21(14-12-20)33-38(35,36)27-16-19(10-15-23(27)30)28(34)32-31-24-17-26(18-6-2-1-3-7-18)37-25-9-5-4-8-22(24)25/h1-16,26,33H,17H2,(H,32,34)/t26-/m1/s1
InChIKQVKPRSJCSTVDLI-AREMUKBSSA-N
TotalMolweight566.464
Molweight566.464
MonoisotopicMass565.062981
CLogP6.3126
CLogS-8.114
H Acceptors7
H Donors2
TotalSurfaceArea398.36
Relative PSA0.21601
PolarSurfaceArea105.24
Druglikeness7.6337
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.52632
Fragments1
Non HAtoms38
NonCHAtoms10
Electronegative Atoms10
StereoCenters1
Rotatable Bond5
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms4
Symmetricatoms5
Amides1
StereoConracemate

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