N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | S233-1806 |
| Compound Name: | N-{[rel-(4aR,7aS)-1-(2-methoxyethyl)-2-oxooctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C23 H30 N4 O4 |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCOC)=O)CNC(c1cc(c2cccc(c2)OC)n[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5801 |
| logD: | 2.5799 |
| logSw: | -2.8256 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.57 |
| InChI Key: | KRENATSMABLPKW-OFNKIYASSA-N |