7-(4-methylbenzene-1-sulfonyl)-N-(2-methylphenyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
Chemical Structure Depiction of
7-(4-methylbenzene-1-sulfonyl)-N-(2-methylphenyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
7-(4-methylbenzene-1-sulfonyl)-N-(2-methylphenyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
Compound characteristics
| Compound ID: | P217-1175 |
| Compound Name: | 7-(4-methylbenzene-1-sulfonyl)-N-(2-methylphenyl)-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C21 H25 N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1CC2CN(CC(C1)O2)C(Nc1ccccc1C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7728 |
| logD: | 2.7728 |
| logSw: | -3.283 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.731 |
| InChI Key: | SOYBVBDEIKQQBX-QZTJIDSGSA-N |