7,9-dimethyl-3-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
7,9-dimethyl-3-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
7,9-dimethyl-3-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | 4925-0641 |
| Compound Name: | 7,9-dimethyl-3-(4-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 353.36 |
| Molecular Formula: | C16 H11 N5 O3 S |
| Smiles: | Cc1cc(C)nc2c1c1c(C(N(c3ccc(cc3)[N+]([O-])=O)N=N1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.9005 |
| logD: | 3.9005 |
| logSw: | -4.1196 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.17 |
| InChI Key: | LRVGOPCJPGHUDX-UHFFFAOYSA-N |