8-chloro-N-(2-methyl-3-nitrophenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Chemical Structure Depiction of
8-chloro-N-(2-methyl-3-nitrophenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
8-chloro-N-(2-methyl-3-nitrophenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Compound characteristics
| Compound ID: | C301-1452 |
| Compound Name: | 8-chloro-N-(2-methyl-3-nitrophenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-amine |
| Molecular Weight: | 354.75 |
| Molecular Formula: | C16 H11 Cl N6 O2 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)Nc1c2nncn2c2cc(ccc2n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6967 |
| logD: | 3.6624 |
| logSw: | -4.0361 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.461 |
| InChI Key: | LIYYWAHEFXZZDN-UHFFFAOYSA-N |