8-bromo-7,9-dimethyl-3-(3-methylphenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
8-bromo-7,9-dimethyl-3-(3-methylphenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
8-bromo-7,9-dimethyl-3-(3-methylphenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D148-0033 |
| Compound Name: | 8-bromo-7,9-dimethyl-3-(3-methylphenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 401.28 |
| Molecular Formula: | C17 H13 Br N4 O S |
| Smiles: | Cc1cccc(c1)N1C(c2c(c3c(C)c(c(C)nc3s2)[Br])N=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.234 |
| logD: | 5.234 |
| logSw: | -5.3188 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.559 |
| InChI Key: | JWXJZXBVKUUETD-UHFFFAOYSA-N |