4-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
4-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
4-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G895-0504 |
| Compound Name: | 4-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | CCOc1ccc(CNC(c2c(C)c3c(ncnc3s2)N2CCCCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2347 |
| logD: | 5.212 |
| logSw: | -4.9888 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.406 |
| InChI Key: | JECAVNJGBJYEQJ-UHFFFAOYSA-N |