N-[rel-(3R,4S)-1-[(4-chloro-3-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclopropanecarboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(4-chloro-3-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclopropanecarboxamide
N-[rel-(3R,4S)-1-[(4-chloro-3-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S823-6633 |
| Compound Name: | N-[rel-(3R,4S)-1-[(4-chloro-3-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]cyclopropanecarboxamide |
| Molecular Weight: | 326.8 |
| Molecular Formula: | C16 H20 Cl F N2 O2 |
| Smiles: | C1CC1C(N[C@@H]1CN(Cc2ccc(c(c2)F)[Cl])C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6693 |
| logD: | 0.2167 |
| logSw: | -2.6278 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.179 |
| InChI Key: | MASKLCXNBHEDTD-SWLSCSKDSA-N |