ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[(4-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[(4-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[(4-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-0133 |
| Compound Name: | ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[(4-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 464.53 |
| Molecular Formula: | C21 H21 F N2 O5 S2 |
| Smiles: | CCOC(CSC1=Nc2c(C(N1Cc1ccc(cc1)F)=O)c(C)c(C(=O)OCC)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.204 |
| logD: | 4.204 |
| logSw: | -4.2691 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.857 |
| InChI Key: | ZDJIXRPYOJWQJB-UHFFFAOYSA-N |