1-[(2-chloro-4-fluorophenyl)methyl]-3-(2,4-dimethoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-(2,4-dimethoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
1-[(2-chloro-4-fluorophenyl)methyl]-3-(2,4-dimethoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Compound characteristics
| Compound ID: | C200-1072 |
| Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-(2,4-dimethoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Molecular Weight: | 486.95 |
| Molecular Formula: | C24 H20 Cl F N2 O4 S |
| Smiles: | COc1ccc(c(c1)OC)N1C(c2c3CCCc3sc2N(Cc2ccc(cc2[Cl])F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5743 |
| logD: | 5.5743 |
| logSw: | -6.1921 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.267 |
| InChI Key: | LIUFCUMRPJSYSV-UHFFFAOYSA-N |