5-(5-bromo-2-methoxyphenyl)-1-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
5-(5-bromo-2-methoxyphenyl)-1-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
5-(5-bromo-2-methoxyphenyl)-1-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D271-0516 |
| Compound Name: | 5-(5-bromo-2-methoxyphenyl)-1-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 436.33 |
| Molecular Formula: | C18 H18 Br N3 O3 S |
| Smiles: | CN1C2=C(C(CC(N2)=O)c2cc(ccc2OC)[Br])C(N=C1SCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9841 |
| logD: | 2.8841 |
| logSw: | -3.4054 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.984 |
| InChI Key: | UITKBXMLKLJFKQ-LBPRGKRZSA-N |