2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G895-0978 |
| Compound Name: | 2,5-dimethyl-N-{2-[4-(methylsulfanyl)phenyl]ethyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 426.6 |
| Molecular Formula: | C22 H26 N4 O S2 |
| Smiles: | Cc1c2c(nc(C)nc2sc1C(NCCc1ccc(cc1)SC)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.8571 |
| logD: | 4.4303 |
| logSw: | -4.7263 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.533 |
| InChI Key: | BCIOYXQCYOJSRO-UHFFFAOYSA-N |