methyl 2-{[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
methyl 2-{[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | K889-0653 |
| Compound Name: | methyl 2-{[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | CC1CCCCN1c1c2c(C)c(C(Nc3ccccc3C(=O)OC)=O)sc2nc(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7577 |
| logD: | 4.0307 |
| logSw: | -4.6702 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.765 |
| InChI Key: | AULQHPLCWHTWIL-ZDUSSCGKSA-N |