1-(4-methoxyphenyl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1H-tetrazole
Chemical Structure Depiction of
1-(4-methoxyphenyl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1H-tetrazole
1-(4-methoxyphenyl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1H-tetrazole
Compound characteristics
| Compound ID: | 8014-9929 |
| Compound Name: | 1-(4-methoxyphenyl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1H-tetrazole |
| Molecular Weight: | 334.31 |
| Molecular Formula: | C11 H10 N8 O3 S |
| Smiles: | Cn1c(nc(n1)[N+]([O-])=O)Sc1nnnn1c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.5624 |
| logD: | 1.5624 |
| logSw: | -2.1089 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 104.667 |
| InChI Key: | BVUQKGWYBOYTEN-UHFFFAOYSA-N |