(E)-N-(3,3-diphenylpropyl)-3-(3-nitrophenyl)prop-2-enamide

Formula:C24H22N2O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(3,3-diphenylpropyl)-3-(3-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName(E)-N-(3,3-diphenylpropyl)-3-(3-nitrophenyl)prop-2-enamide
MolecularFormulaC24H22N2O3
Smiles[O-][N+](c1cc(/C=C/C(NCCC(c2ccccc2)c2ccccc2)=O)ccc1)=O
InChIInChI=1S/C24H22N2O3/c27-24(15-14-19-8-7-13-22(18-19)26(28)29)25-17-16-23(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-15,18,23H,16-17H2,(H,25,27)
InChIKJPJDFFZCGIHDLN-UHFFFAOYSA-N
TotalMolweight386.45
Molweight386.45
MonoisotopicMass386.163043
CLogP4.3362
CLogS-5.305
H Acceptors5
H Donors1
TotalSurfaceArea312.18
Relative PSA0.17592
PolarSurfaceArea74.92
Druglikeness-4.3583
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro
Shape Index0.55172
Fragments1
Non HAtoms29
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms4
Symmetricatoms8
Amides1
AcidicOxygens1
StereoCon

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