4-nitro-N-[(3-oxatricyclo[3.2.1.0~2,4~]octan-6-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-nitro-N-[(3-oxatricyclo[3.2.1.0~2,4~]octan-6-yl)methyl]benzene-1-sulfonamide
4-nitro-N-[(3-oxatricyclo[3.2.1.0~2,4~]octan-6-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4063-0168 |
| Compound Name: | 4-nitro-N-[(3-oxatricyclo[3.2.1.0~2,4~]octan-6-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 324.35 |
| Molecular Formula: | C14 H16 N2 O5 S |
| Smiles: | C1C(CNS(c2ccc(cc2)[N+]([O-])=O)(=O)=O)C2CC1C1C2O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3451 |
| logD: | 2.345 |
| logSw: | -2.8248 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.486 |
| InChI Key: | SFWKSCYIROBPOV-UHFFFAOYSA-N |