4-methylphenyl 3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
4-methylphenyl 3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
4-methylphenyl 3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K833-0118 |
| Compound Name: | 4-methylphenyl 3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 408.45 |
| Molecular Formula: | C22 H17 F N2 O3 S |
| Smiles: | Cc1ccc(cc1)OC(c1c(C)c2C(N(Cc3ccccc3F)C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6556 |
| logD: | 4.6556 |
| logSw: | -4.5738 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.619 |
| InChI Key: | BQSTVAYUKUVGLF-UHFFFAOYSA-N |