1-[(2-chloro-4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
1-[(2-chloro-4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C258-0307 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 470.95 |
| Molecular Formula: | C24 H20 Cl F N2 O3 S |
| Smiles: | COc1cccc(c1)N1C(c2c3CCCCc3sc2N(Cc2ccc(cc2[Cl])F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9453 |
| logD: | 5.9453 |
| logSw: | -6.2584 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.571 |
| InChI Key: | WSJDCFPZCABKRE-UHFFFAOYSA-N |