N-{[1-(4-ethoxyphenyl)-1H-tetrazol-5-yl]methyl}-2-methyl-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-{[1-(4-ethoxyphenyl)-1H-tetrazol-5-yl]methyl}-2-methyl-5-nitrobenzene-1-sulfonamide
N-{[1-(4-ethoxyphenyl)-1H-tetrazol-5-yl]methyl}-2-methyl-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G745-1621 |
| Compound Name: | N-{[1-(4-ethoxyphenyl)-1H-tetrazol-5-yl]methyl}-2-methyl-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 418.43 |
| Molecular Formula: | C17 H18 N6 O5 S |
| Smiles: | CCOc1ccc(cc1)n1c(CNS(c2cc(ccc2C)[N+]([O-])=O)(=O)=O)nnn1 |
| Stereo: | ACHIRAL |
| logP: | 2.6975 |
| logD: | 2.0994 |
| logSw: | -3.098 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.818 |
| InChI Key: | GAMVBXMKTPINSN-UHFFFAOYSA-N |