1-[(2-chloro-4-fluorophenyl)methyl]-3-(4-ethoxyphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[(2-chloro-4-fluorophenyl)methyl]-3-(4-ethoxyphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
1-[(2-chloro-4-fluorophenyl)methyl]-3-(4-ethoxyphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | C241-0572 |
Compound Name: | 1-[(2-chloro-4-fluorophenyl)methyl]-3-(4-ethoxyphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
Molecular Weight: | 430.88 |
Molecular Formula: | C21 H16 Cl F N2 O3 S |
Smiles: | CCOc1ccc(cc1)N1C(c2c(ccs2)N(Cc2ccc(cc2[Cl])F)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0041 |
logD: | 5.0041 |
logSw: | -5.1213 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 38.797 |
InChI Key: | FMCKOTDHWJODII-UHFFFAOYSA-N |