3-(4-acetylphenyl)-8-bromo-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
3-(4-acetylphenyl)-8-bromo-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
3-(4-acetylphenyl)-8-bromo-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D148-0413 |
| Compound Name: | 3-(4-acetylphenyl)-8-bromo-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 429.29 |
| Molecular Formula: | C18 H13 Br N4 O2 S |
| Smiles: | CC(c1ccc(cc1)N1C(c2c(c3c(C)c(c(C)nc3s2)[Br])N=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2729 |
| logD: | 4.2729 |
| logSw: | -4.5868 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.386 |
| InChI Key: | PAMWAZZPCJUWHX-UHFFFAOYSA-N |