7-(3-fluorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
Chemical Structure Depiction of
7-(3-fluorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
7-(3-fluorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
Compound characteristics
| Compound ID: | P217-1560 |
| Compound Name: | 7-(3-fluorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide |
| Molecular Weight: | 449.5 |
| Molecular Formula: | C21 H24 F N3 O5 S |
| Smiles: | COc1ccc(CNC(N2CC3CN(CC(C2)O3)S(c2cccc(c2)F)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8578 |
| logD: | 1.8578 |
| logSw: | -2.6957 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.295 |
| InChI Key: | KXQCJZMINVEAEU-KDURUIRLSA-N |