N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-6-methoxypyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-6-methoxypyridine-3-carboxamide
N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-6-methoxypyridine-3-carboxamide
Compound characteristics
| Compound ID: | T987-2602 |
| Compound Name: | N-[rel-(1R,2S)-2-{[(3-ethoxyphenyl)methyl]carbamoyl}cyclopentyl]-6-methoxypyridine-3-carboxamide |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C22 H27 N3 O4 |
| Smiles: | CCOc1cccc(CNC([C@H]2CCC[C@H]2NC(c2ccc(nc2)OC)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4152 |
| logD: | 2.4152 |
| logSw: | -2.7858 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.252 |
| InChI Key: | NUPQOHBGNAUKPI-MOPGFXCFSA-N |