1-(2,5-dimethoxyphenyl)-3-nitro-1H-1,2,4-triazole
Chemical Structure Depiction of
1-(2,5-dimethoxyphenyl)-3-nitro-1H-1,2,4-triazole
1-(2,5-dimethoxyphenyl)-3-nitro-1H-1,2,4-triazole
Compound characteristics
Compound ID: | 8020-2001 |
Compound Name: | 1-(2,5-dimethoxyphenyl)-3-nitro-1H-1,2,4-triazole |
Molecular Weight: | 250.21 |
Molecular Formula: | C10 H10 N4 O4 |
Smiles: | COc1ccc(c(c1)n1cnc(n1)[N+]([O-])=O)OC |
Stereo: | ACHIRAL |
logP: | 1.5452 |
logD: | 1.5452 |
logSw: | -1.9725 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 71.36 |
InChI Key: | YJFSJKIAYGTIPP-UHFFFAOYSA-N |