1-[(2-chloro-4-fluorophenyl)methyl]-5,6-dimethyl-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-5,6-dimethyl-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
1-[(2-chloro-4-fluorophenyl)methyl]-5,6-dimethyl-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C242-1019 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-5,6-dimethyl-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 442.94 |
| Molecular Formula: | C23 H20 Cl F N2 O2 S |
| Smiles: | Cc1c2C(N(CCc3ccccc3)C(N(Cc3ccc(cc3[Cl])F)c2sc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1781 |
| logD: | 6.1781 |
| logSw: | -6.1837 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.697 |
| InChI Key: | LGHMBLBRMDESFF-UHFFFAOYSA-N |