3-(methanesulfonyl)-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(methanesulfonyl)-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole
3-(methanesulfonyl)-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 8017-4480 |
| Compound Name: | 3-(methanesulfonyl)-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole |
| Molecular Weight: | 300.29 |
| Molecular Formula: | C9 H12 N6 O4 S |
| Smiles: | Cc1ncc([N+]([O-])=O)n1Cc1nnc(n1C)S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.4321 |
| logD: | -1.4568 |
| logSw: | -1.4178 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 101.14 |
| InChI Key: | MYOXRPLOXPQBJT-UHFFFAOYSA-N |