2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | G895-1154 |
Compound Name: | 2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(piperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
Molecular Weight: | 440.63 |
Molecular Formula: | C23 H28 N4 O S2 |
Smiles: | Cc1c2c(nc(C)nc2sc1C(NCCc1ccc(cc1)SC)=O)N1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 5.2737 |
logD: | 4.8469 |
logSw: | -5.1337 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.167 |
InChI Key: | OIKMHKHXPHDROM-UHFFFAOYSA-N |