rel-(1R,2R,4R)-N-cyclopentyl-2-[3-(1H-indol-3-yl)propanamido]-4-{[(pyridin-3-yl)oxy]methyl}cyclopentane-1-carboxamide
Chemical Structure Depiction of
rel-(1R,2R,4R)-N-cyclopentyl-2-[3-(1H-indol-3-yl)propanamido]-4-{[(pyridin-3-yl)oxy]methyl}cyclopentane-1-carboxamide
rel-(1R,2R,4R)-N-cyclopentyl-2-[3-(1H-indol-3-yl)propanamido]-4-{[(pyridin-3-yl)oxy]methyl}cyclopentane-1-carboxamide
Compound characteristics
| Compound ID: | SD06-0437 |
| Compound Name: | rel-(1R,2R,4R)-N-cyclopentyl-2-[3-(1H-indol-3-yl)propanamido]-4-{[(pyridin-3-yl)oxy]methyl}cyclopentane-1-carboxamide |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C28 H34 N4 O3 |
| Smiles: | C1CCC(C1)NC([C@@H]1C[C@H](C[C@H]1NC(CCc1c[nH]c2ccccc12)=O)COc1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8117 |
| logD: | 3.8066 |
| logSw: | -4.2753 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.041 |
| InChI Key: | RJPAGNQAQKJBEN-LUPFDQBXSA-N |