(E)-N-benzyl-N-[2-[benzyl-[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]-3-(furan-2-yl)prop-2-enamide

Formula:C30H28N2O4 Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-N-benzyl-N-[2-[benzyl-[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]-3-(furan-2-yl)prop-2-enamide is a drug-like molecule.

MolName(E)-N-benzyl-N-[2-[benzyl-[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]-3-(furan-2-yl)prop-2-enamide
MolecularFormulaC30H28N2O4
SmilesO=C(/C=C/c1ccco1)N(CCN(Cc1ccccc1)C(/C=C/c1ccco1)=O)Cc1ccccc1
InChIInChI=1S/C30H28N2O4/c33-29(17-15-27-13-7-21-35-27)31(23-25-9-3-1-4-10-25)19-20-32(24-26-11-5-2-6-12-26)30(34)18-16-28-14-8-22-36-28/h1-18,21-22H,19-20,23-24H2
InChIKYHHXRSKBUCNTPT-UHFFFAOYSA-N
TotalMolweight480.562
Molweight480.562
MonoisotopicMass480.204908
CLogP4.4372
CLogS-4.884
H Acceptors6
TotalSurfaceArea396.06
Relative PSA0.15503
PolarSurfaceArea66.9
Druglikeness2.2633
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.44444
Fragments1
Non HAtoms36
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond11
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms4
Symmetricatoms20
Amides2
StereoCon

Request More Details | (E)-N-benzyl-N-[2-[benzyl-[(E)-3-(furan-2-yl)prop-2-enoyl]amino]ethyl]-3-(furan-2-yl)prop-2-enamide


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments