2-methyl-N-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]methyl}-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
2-methyl-N-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]methyl}-5-nitrobenzene-1-sulfonamide
2-methyl-N-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]methyl}-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G745-1653 |
| Compound Name: | 2-methyl-N-{[1-(4-methylphenyl)-1H-tetrazol-5-yl]methyl}-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 388.4 |
| Molecular Formula: | C16 H16 N6 O4 S |
| Smiles: | Cc1ccc(cc1)n1c(CNS(c2cc(ccc2C)[N+]([O-])=O)(=O)=O)nnn1 |
| Stereo: | ACHIRAL |
| logP: | 2.7519 |
| logD: | 2.1539 |
| logSw: | -3.2116 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 115.695 |
| InChI Key: | YELBDWJYLIHVNN-UHFFFAOYSA-N |