N-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]phenyl]furan-2-carboxamide

Formula:C20H13NO3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]phenyl]furan-2-carboxamide is a drug-like molecule.

MolNameN-[4-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]phenyl]furan-2-carboxamide
MolecularFormulaC20H13NO3Cl2
SmilesO=C(/C=C/c(ccc(Cl)c1)c1Cl)c(cc1)ccc1NC(c1ccco1)=O
InChIInChI=1S/C20H13Cl2NO3/c21-15-7-3-13(17(22)12-15)6-10-18(24)14-4-8-16(9-5-14)23-20(25)19-2-1-11-26-19/h1-12H,(H,23,25)
InChIKRPSAMOPNICWICB-UHFFFAOYSA-N
TotalMolweight386.233
Molweight386.233
MonoisotopicMass385.027248
CLogP4.852
CLogS-6.506
H Acceptors4
H Donors1
TotalSurfaceArea286.77
Relative PSA0.18011
PolarSurfaceArea59.31
Druglikeness2.414
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.65385
Fragments1
Non HAtoms26
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Symmetricatoms2
Amides1
StereoCon

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