5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-(propylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Chemical Structure Depiction of
5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-(propylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-(propylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Compound characteristics
| Compound ID: | D392-0249 |
| Compound Name: | 5-{3-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-2-(propylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | CCCSC1NC(C2C(CC(NC=2N=1)=O)c1ccc(c(c1)OC)OCC#C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8709 |
| logD: | 1.8532 |
| logSw: | -2.7725 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.275 |
| InChI Key: | RPFKIDPYEUZAJJ-CYBMUJFWSA-N |