7-[(4-nitrobenzene-1-sulfonyl)methyl]-7,8-dihydro[1,4]thiazino[4,3,2-gh]purine
Chemical Structure Depiction of
7-[(4-nitrobenzene-1-sulfonyl)methyl]-7,8-dihydro[1,4]thiazino[4,3,2-gh]purine
7-[(4-nitrobenzene-1-sulfonyl)methyl]-7,8-dihydro[1,4]thiazino[4,3,2-gh]purine
Compound characteristics
| Compound ID: | 8016-5082 |
| Compound Name: | 7-[(4-nitrobenzene-1-sulfonyl)methyl]-7,8-dihydro[1,4]thiazino[4,3,2-gh]purine |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C14 H11 N5 O4 S2 |
| Smiles: | C1C(CS(c2ccc(cc2)[N+]([O-])=O)(=O)=O)n2cnc3c2c(ncn3)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1219 |
| logD: | 1.1219 |
| logSw: | -2.3002 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 95.812 |
| InChI Key: | GNMAKPTYNHICNT-SNVBAGLBSA-N |