5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-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-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-1-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-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: | D392-0909 |
| Compound Name: | 5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-1-methyl-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | CN1C2=C(C(CC(N2)=O)c2ccc(c(c2)OC)OCC#C)C(N=C1SCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9017 |
| logD: | 1.8016 |
| logSw: | -2.8274 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.488 |
| InChI Key: | ZMVDIZNQORYQKV-AWEZNQCLSA-N |