N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | V025-7467 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide |
| Molecular Weight: | 530.93 |
| Molecular Formula: | C27 H22 Cl F3 N2 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(C1CN(CC1c1cccc(c1)C(F)(F)F)C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8471 |
| logD: | 4.8471 |
| logSw: | -5.1019 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.377 |
| InChI Key: | DRMXODINIUBPRQ-UHFFFAOYSA-N |