N-[rel-(1R,2S)-2-{4-[(4-fluorophenyl)methyl]piperazine-1-carbonyl}cyclopentyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-2-{4-[(4-fluorophenyl)methyl]piperazine-1-carbonyl}cyclopentyl]-4-methoxybenzamide
N-[rel-(1R,2S)-2-{4-[(4-fluorophenyl)methyl]piperazine-1-carbonyl}cyclopentyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | T987-2294 |
| Compound Name: | N-[rel-(1R,2S)-2-{4-[(4-fluorophenyl)methyl]piperazine-1-carbonyl}cyclopentyl]-4-methoxybenzamide |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C25 H30 F N3 O3 |
| Smiles: | COc1ccc(cc1)C(N[C@@H]1CCC[C@@H]1C(N1CCN(CC1)Cc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5472 |
| logD: | 2.5258 |
| logSw: | -2.8973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.866 |
| InChI Key: | MESSAICIBPETOO-PKTZIBPZSA-N |