N-butyl-2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-butyl-2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-butyl-2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | F795-0021 |
| Compound Name: | N-butyl-2-{3-[3-(methylsulfanyl)phenyl]-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C22 H22 N4 O3 S2 |
| Smiles: | CCCCNC(CN1C(N(C(c2c1c1cccnc1s2)=O)c1cccc(c1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2762 |
| logD: | 3.2762 |
| logSw: | -3.4462 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.55 |
| InChI Key: | VJXXIXGMKSSFNI-UHFFFAOYSA-N |