2-(benzylsulfanyl)-5-(5-bromo-2-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Chemical Structure Depiction of
2-(benzylsulfanyl)-5-(5-bromo-2-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
2-(benzylsulfanyl)-5-(5-bromo-2-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Compound characteristics
| Compound ID: | D271-0133 |
| Compound Name: | 2-(benzylsulfanyl)-5-(5-bromo-2-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione |
| Molecular Weight: | 472.36 |
| Molecular Formula: | C21 H18 Br N3 O3 S |
| Smiles: | COc1ccc(cc1C1CC(NC2=C1C(NC(=N2)SCc1ccccc1)=O)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2043 |
| logD: | 3.1944 |
| logSw: | -3.4782 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.499 |
| InChI Key: | KQYMJMIRLZNSNE-HNNXBMFYSA-N |