4-(azepan-1-yl)-6-methyl-N-[3-(methylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-(azepan-1-yl)-6-methyl-N-[3-(methylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-5-carboxamide
4-(azepan-1-yl)-6-methyl-N-[3-(methylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | P058-0855 |
| Compound Name: | 4-(azepan-1-yl)-6-methyl-N-[3-(methylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 412.57 |
| Molecular Formula: | C21 H24 N4 O S2 |
| Smiles: | Cc1c(C(Nc2cccc(c2)SC)=O)c2c(ncnc2s1)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.6234 |
| logD: | 5.6234 |
| logSw: | -5.6638 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.961 |
| InChI Key: | DTEJMXHMEYLXJJ-UHFFFAOYSA-N |