N-(2,5-dimethylphenyl)-2-{[6-ethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-{[6-ethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(2,5-dimethylphenyl)-2-{[6-ethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | 4408-0043 |
Compound Name: | N-(2,5-dimethylphenyl)-2-{[6-ethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide |
Molecular Weight: | 413.56 |
Molecular Formula: | C21 H23 N3 O2 S2 |
Smiles: | CCc1cc2C(N(CC=C)C(=Nc2s1)SCC(Nc1cc(C)ccc1C)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1755 |
logD: | 4.1755 |
logSw: | -4.1411 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.375 |
InChI Key: | QCPQGHLHIYLDOF-UHFFFAOYSA-N |