8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D369-0041 |
| Compound Name: | 8-bromo-3-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 367.26 |
| Molecular Formula: | C14 H15 Br N4 O S |
| Smiles: | CCCCN1C(c2c(c3c(C)c(c(C)nc3s2)[Br])N=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4707 |
| logD: | 4.4706 |
| logSw: | -4.308 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.228 |
| InChI Key: | AWNUKOBJEUWPIM-UHFFFAOYSA-N |