ethyl 2-{[2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
ethyl 2-{[2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | K889-0887 |
| Compound Name: | ethyl 2-{[2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C24 H28 N4 O3 S |
| Smiles: | CCOC(c1ccccc1NC(c1c(C)c2c(nc(C)nc2s1)N1CCC(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6205 |
| logD: | 4.8935 |
| logSw: | -5.6521 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.06 |
| InChI Key: | PJPJOPNUDYXBOX-UHFFFAOYSA-N |