ethyl 4-amino-2-({2-[(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({2-[(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({2-[(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0131 |
| Compound Name: | ethyl 4-amino-2-({2-[(2-methyl-4-oxo-6,7-dihydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C19 H20 N6 O4 S2 |
| Smiles: | CCOC(c1cnc(nc1N)SCC(NN1C(C)=Nc2c(C1=O)c1CCCc1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6142 |
| logD: | 1.6141 |
| logSw: | -2.2907 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.027 |
| InChI Key: | TUDMMWGOTURADA-UHFFFAOYSA-N |