4-ethylphenyl 3-[(2-chlorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
4-ethylphenyl 3-[(2-chlorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
4-ethylphenyl 3-[(2-chlorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K833-0154 |
| Compound Name: | 4-ethylphenyl 3-[(2-chlorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 438.93 |
| Molecular Formula: | C23 H19 Cl N2 O3 S |
| Smiles: | CCc1ccc(cc1)OC(c1c(C)c2C(N(Cc3ccccc3[Cl])C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5064 |
| logD: | 5.5064 |
| logSw: | -6.0871 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.619 |
| InChI Key: | SVPQMTDSGOLKQK-UHFFFAOYSA-N |