[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl] (Z)-3-(4-chlorophenyl)-2-(4-fluorophenyl)prop-2-enoate

Formula:C24H24N2O4ClF Mutagenic:none Tumorigenic:none Reproductive Effective:high [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl] (Z)-3-(4-chlorophenyl)-2-(4-fluorophenyl)prop-2-enoate is a drug-like molecule.

MolName[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl] (Z)-3-(4-chlorophenyl)-2-(4-fluorophenyl)prop-2-enoate
MolecularFormulaC24H24N2O4ClF
SmilesO=C(COC(/C(/c(cc1)ccc1F)=C\c(cc1)ccc1Cl)=O)NCCCN(CCC1)C1=O
InChIInChI=1S/C24H24ClFN2O4/c25-19-8-4-17(5-9-19)15-21(18-6-10-20(26)11-7-18)24(31)32-16-22(29)27-12-2-14-28-13-1-3-23(28)30/h4-11,15H,1-3,12-14,16H2,(H,27,29)
InChIKFTMSXMVXEDRQME-UHFFFAOYSA-N
TotalMolweight458.916
Molweight458.916
MonoisotopicMass458.140863
CLogP3.4081
CLogS-4.262
H Acceptors6
H Donors1
TotalSurfaceArea347.33
Relative PSA0.18464
PolarSurfaceArea75.71
Druglikeness4.2683
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantlow
Nasty Functions
Shape Index0.5625
Fragments1
Non HAtoms32
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond10
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms8
Symmetricatoms4
Amides2
StereoCon

Request More Details | [2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl] (Z)-3-(4-chlorophenyl)-2-(4-fluorophenyl)prop-2-enoate


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