1-(2,4-dichlorophenyl)-N-(3-{[(4-nitrophenyl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl)methanimine
Chemical Structure Depiction of
1-(2,4-dichlorophenyl)-N-(3-{[(4-nitrophenyl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl)methanimine
1-(2,4-dichlorophenyl)-N-(3-{[(4-nitrophenyl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl)methanimine
Compound characteristics
| Compound ID: | 8005-2408 |
| Compound Name: | 1-(2,4-dichlorophenyl)-N-(3-{[(4-nitrophenyl)methyl]sulfanyl}-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl)methanimine |
| Molecular Weight: | 448.29 |
| Molecular Formula: | C17 H11 Cl2 N7 O2 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Sc1nnc2n(cnn12)/N=C/c1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9011 |
| logD: | 3.9011 |
| logSw: | -4.2499 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.981 |
| InChI Key: | DBHCBYDXAWZGPW-UHFFFAOYSA-N |