2-[(4-chlorophenyl)sulfonylamino]-N-[(Z)-(4-oxochromen-3-yl)methylideneamino]benzamide

Formula:C23H16N3O5ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(4-chlorophenyl)sulfonylamino]-N-[(Z)-(4-oxochromen-3-yl)methylideneamino]benzamide is a drug-like molecule.

MolName2-[(4-chlorophenyl)sulfonylamino]-N-[(Z)-(4-oxochromen-3-yl)methylideneamino]benzamide
MolecularFormulaC23H16N3O5ClS
SmilesO=C(c(cccc1)c1NS(c(cc1)ccc1Cl)(=O)=O)N/N=C\C1=COc(cccc2)c2C1=O
InChIInChI=1S/C23H16ClN3O5S/c24-16-9-11-17(12-10-16)33(30,31)27-20-7-3-1-5-18(20)23(29)26-25-13-15-14-32-21-8-4-2-6-19(21)22(15)28/h1-14,27H,(H,26,29)
InChIKRATQAPYLSHKCQX-UHFFFAOYSA-N
TotalMolweight481.915
Molweight481.915
MonoisotopicMass481.049919
CLogP3.2241
CLogS-6.34
H Acceptors8
H Donors2
TotalSurfaceArea341.17
Relative PSA0.29044
PolarSurfaceArea122.31
Druglikeness7.9896
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionstwice activated DB; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.57576
Fragments1
Non HAtoms33
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms3
Amides1
StereoCon

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