N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-4-methyl-1,3-oxazole-5-carboxamide
Chemical Structure Depiction of
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-4-methyl-1,3-oxazole-5-carboxamide
N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-4-methyl-1,3-oxazole-5-carboxamide
Compound characteristics
| Compound ID: | S233-2117 |
| Compound Name: | N-{[rel-(4aR,7aS)-1-benzyl-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-4-methyl-1,3-oxazole-5-carboxamide |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C21 H25 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2Cc1ccccc1)=O)CNC(c1c(C)nco1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9464 |
| logD: | 1.9464 |
| logSw: | -2.3079 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.858 |
| InChI Key: | XHNUSZFAJMMMHN-UTKZUKDTSA-N |