1-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
1-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C200-0624 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-5,6-dimethylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 442.94 |
| Molecular Formula: | C23 H20 Cl F N2 O2 S |
| Smiles: | Cc1ccc(cc1C)N1C(c2c(C)c(C)sc2N(Cc2ccc(cc2[Cl])F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4564 |
| logD: | 6.4564 |
| logSw: | -6.4844 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.107 |
| InChI Key: | BYKPTSHVLMNWGL-UHFFFAOYSA-N |