rel-(1R,5S)-3-(3-methoxybenzene-1-sulfonyl)-7-methyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane
Chemical Structure Depiction of
rel-(1R,5S)-3-(3-methoxybenzene-1-sulfonyl)-7-methyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane
rel-(1R,5S)-3-(3-methoxybenzene-1-sulfonyl)-7-methyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane
Compound characteristics
| Compound ID: | S301-0637 |
| Compound Name: | rel-(1R,5S)-3-(3-methoxybenzene-1-sulfonyl)-7-methyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane |
| Molecular Weight: | 312.39 |
| Molecular Formula: | C14 H20 N2 O4 S |
| Smiles: | CN1C[C@H]2CN(C[C@@H](C1)O2)S(c1cccc(c1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7597 |
| logD: | 0.7218 |
| logSw: | -2.1226 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.172 |
| InChI Key: | RROLYYZAJBARGX-STQMWFEESA-N |