N-(2-fluorophenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
N-(2-fluorophenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S534-0240 |
| Compound Name: | N-(2-fluorophenyl)-2-[(pyrrolidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 319.42 |
| Molecular Formula: | C18 H26 F N3 O |
| Smiles: | C1CCC(CN2CCCC2)N(CC1)C(Nc1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2347 |
| logD: | 0.3249 |
| logSw: | -3.3258 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.0855 |
| InChI Key: | COEJURBTHHVXGW-UHFFFAOYSA-N |