3-[2-(3,4-diethoxyphenyl)ethyl]-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,4-diethoxyphenyl)ethyl]-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
3-[2-(3,4-diethoxyphenyl)ethyl]-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Compound characteristics
| Compound ID: | D369-0123 |
| Compound Name: | 3-[2-(3,4-diethoxyphenyl)ethyl]-7-methylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C21 H22 N4 O3 S |
| Smiles: | CCOc1ccc(CCN2C(c3c(c4ccc(C)nc4s3)N=N2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.1386 |
| logD: | 4.1382 |
| logSw: | -4.213 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.606 |
| InChI Key: | PZRWOGULNBNUJW-UHFFFAOYSA-N |