N-[(E)-3-oxo-1-phenyl-3-(1,3-thiazol-2-ylamino)prop-1-en-2-yl]benzamide

Formula:C19H15N3O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3-oxo-1-phenyl-3-(1,3-thiazol-2-ylamino)prop-1-en-2-yl]benzamide is a drug-like molecule.

MolNameN-[(E)-3-oxo-1-phenyl-3-(1,3-thiazol-2-ylamino)prop-1-en-2-yl]benzamide
MolecularFormulaC19H15N3O2S
SmilesO=C(/C(/NC(c1ccccc1)=O)=C\c1ccccc1)Nc1nccs1
InChIInChI=1S/C19H15N3O2S/c23-17(15-9-5-2-6-10-15)21-16(13-14-7-3-1-4-8-14)18(24)22-19-20-11-12-25-19/h1-13H,(H,21,23)(H,20,22,24)
InChIKDRNDZRQACHEQRQ-UHFFFAOYSA-N
TotalMolweight349.413
Molweight349.413
MonoisotopicMass349.088497
CLogP4.0491
CLogS-4.606
H Acceptors5
H Donors2
TotalSurfaceArea270.61
Relative PSA0.29685
PolarSurfaceArea99.33
Druglikeness3.7965
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! thiazol-2-ylamine
Shape Index0.48
Fragments1
Non HAtoms25
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Symmetricatoms4
Amides2
Aromatic Nitrogens1
StereoCon

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