methyl 2-{[4-(diethylamino)-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(diethylamino)-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
methyl 2-{[4-(diethylamino)-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | K892-0418 |
| Compound Name: | methyl 2-{[4-(diethylamino)-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]amino}benzoate |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C20 H22 N4 O3 S |
| Smiles: | CCN(CC)c1c2c(C)c(C(Nc3ccccc3C(=O)OC)=O)sc2ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.1556 |
| logD: | 3.4286 |
| logSw: | -4.4281 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.39 |
| InChI Key: | ISHQNIXUBMTMJW-UHFFFAOYSA-N |