3-[(2-chloro-4-fluorophenyl)methyl]-1-ethyl-7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2-chloro-4-fluorophenyl)methyl]-1-ethyl-7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
3-[(2-chloro-4-fluorophenyl)methyl]-1-ethyl-7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L559-0685 |
| Compound Name: | 3-[(2-chloro-4-fluorophenyl)methyl]-1-ethyl-7-(4-methoxyphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 440.86 |
| Molecular Formula: | C22 H18 Cl F N4 O3 |
| Smiles: | CCN1C(N(Cc2ccc(cc2[Cl])F)C(c2cnc(c3ccc(cc3)OC)nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0532 |
| logD: | 5.0532 |
| logSw: | -5.1858 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.911 |
| InChI Key: | AZWHMSDCDVODCT-UHFFFAOYSA-N |