N-[rel-(1R,2S)-2-{[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]carbamoyl}cyclopentyl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-2-{[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]carbamoyl}cyclopentyl]-4-methoxybenzamide
N-[rel-(1R,2S)-2-{[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]carbamoyl}cyclopentyl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | T987-2302 |
| Compound Name: | N-[rel-(1R,2S)-2-{[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]carbamoyl}cyclopentyl]-4-methoxybenzamide |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | COc1ccc(cc1)C(N[C@@H]1CCC[C@@H]1C(NCCCN1CCCc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.3609 |
| logD: | 3.3049 |
| logSw: | -3.5154 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.744 |
| InChI Key: | KCBQZVIYWWOOSH-PKTZIBPZSA-N |