7-(4-chlorophenyl)-1-ethyl-3-[(pyridin-4-yl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-(4-chlorophenyl)-1-ethyl-3-[(pyridin-4-yl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-(4-chlorophenyl)-1-ethyl-3-[(pyridin-4-yl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L559-0747 |
| Compound Name: | 7-(4-chlorophenyl)-1-ethyl-3-[(pyridin-4-yl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 393.83 |
| Molecular Formula: | C20 H16 Cl N5 O2 |
| Smiles: | CCN1C(N(Cc2ccncc2)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5842 |
| logD: | 3.583 |
| logSw: | -3.9417 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.796 |
| InChI Key: | VQTURILBKLSEBY-UHFFFAOYSA-N |