4-methoxy-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-methoxy-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide
4-methoxy-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | S233-2018 |
| Compound Name: | 4-methoxy-N-{[rel-(4aR,7aS)-2-oxo-1-propyloctahydro-4aH-cyclopenta[b]pyridin-4a-yl]methyl}benzene-1-sulfonamide |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C19 H28 N2 O4 S |
| Smiles: | [H][C@@]12CCC[C@]1(CCC(N2CCC)=O)CNS(c1ccc(cc1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7664 |
| logD: | 2.7664 |
| logSw: | -3.3214 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.082 |
| InChI Key: | XDDKEZKBMUMMFQ-MJGOQNOKSA-N |