4-(azepan-1-yl)-N-[2-(4-chlorophenyl)ethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
4-(azepan-1-yl)-N-[2-(4-chlorophenyl)ethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
4-(azepan-1-yl)-N-[2-(4-chlorophenyl)ethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G895-0316 |
| Compound Name: | 4-(azepan-1-yl)-N-[2-(4-chlorophenyl)ethyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 428.98 |
| Molecular Formula: | C22 H25 Cl N4 O S |
| Smiles: | Cc1c2c(ncnc2sc1C(NCCc1ccc(cc1)[Cl])=O)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.394 |
| logD: | 5.3713 |
| logSw: | -5.848 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.124 |
| InChI Key: | KREKLWIRYIVZHS-UHFFFAOYSA-N |