(E)-3-(4-chlorophenyl)-N-[(4-sulfamoylphenyl)methyl]prop-2-enamide

Formula:C16H15N2O3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-chlorophenyl)-N-[(4-sulfamoylphenyl)methyl]prop-2-enamide is a drug-like molecule.

MolName(E)-3-(4-chlorophenyl)-N-[(4-sulfamoylphenyl)methyl]prop-2-enamide
MolecularFormulaC16H15N2O3ClS
SmilesNS(c1ccc(CNC(/C=C/c(cc2)ccc2Cl)=O)cc1)(=O)=O
InChIInChI=1S/C16H15ClN2O3S/c17-14-6-1-12(2-7-14)5-10-16(20)19-11-13-3-8-15(9-4-13)23(18,21)22/h1-10H,11H2,(H,19,20)(H2,18,21,22)
InChIKCYSWFFDIWZCECW-UHFFFAOYSA-N
TotalMolweight350.825
Molweight350.825
MonoisotopicMass350.04919
CLogP2.2157
CLogS-3.949
H Acceptors5
H Donors2
TotalSurfaceArea255.01
Relative PSA0.26803
PolarSurfaceArea97.64
Druglikeness3.2379
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.69565
Fragments1
Non HAtoms23
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms5
Amides2
StereoCon

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