8-bromo-7,9-dimethyl-3-(2-phenylethyl)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-(2-phenylethyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
8-bromo-7,9-dimethyl-3-(2-phenylethyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D148-0463 |
| Compound Name: | 8-bromo-7,9-dimethyl-3-(2-phenylethyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 415.31 |
| Molecular Formula: | C18 H15 Br N4 O S |
| Smiles: | Cc1c(c(C)nc2c1c1c(C(N(CCc3ccccc3)N=N1)=O)s2)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8958 |
| logD: | 4.8958 |
| logSw: | -4.8953 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.956 |
| InChI Key: | XZEYVHXQXQZGQW-UHFFFAOYSA-N |