6-acetyl-3-(4-chlorophenyl)-1-[(3-fluorophenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-acetyl-3-(4-chlorophenyl)-1-[(3-fluorophenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
6-acetyl-3-(4-chlorophenyl)-1-[(3-fluorophenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C200-0726 |
| Compound Name: | 6-acetyl-3-(4-chlorophenyl)-1-[(3-fluorophenyl)methyl]-5-methylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 442.89 |
| Molecular Formula: | C22 H16 Cl F N2 O3 S |
| Smiles: | CC(c1c(C)c2C(N(C(N(Cc3cccc(c3)F)c2s1)=O)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6386 |
| logD: | 4.6386 |
| logSw: | -5.0641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.934 |
| InChI Key: | URBNRHGDRGCUAE-UHFFFAOYSA-N |