butyl 4-(7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate
Chemical Structure Depiction of
butyl 4-(7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate
butyl 4-(7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate
Compound characteristics
| Compound ID: | D148-5023 |
| Compound Name: | butyl 4-(7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)benzoate |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CCCCOC(c1ccc(cc1)N1C(c2c(c3c(C)cc(C)nc3s2)N=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.561 |
| logD: | 5.561 |
| logSw: | -5.5929 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.836 |
| InChI Key: | ZTWZECZVCKLIQK-UHFFFAOYSA-N |