1-[(2-chloro-6-fluorophenyl)methyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-6-fluorophenyl)methyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
1-[(2-chloro-6-fluorophenyl)methyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C200-0816 |
| Compound Name: | 1-[(2-chloro-6-fluorophenyl)methyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 484.98 |
| Molecular Formula: | C25 H22 Cl F N2 O3 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2c3CCCCc3sc2N(Cc2c(cccc2[Cl])F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.901 |
| logD: | 5.901 |
| logSw: | -6.1603 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.151 |
| InChI Key: | AKAZDQNEWCQHFF-UHFFFAOYSA-N |