1-methyl-5-{2-[(3-methylphenyl)methoxy]phenyl}-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
1-methyl-5-{2-[(3-methylphenyl)methoxy]phenyl}-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
1-methyl-5-{2-[(3-methylphenyl)methoxy]phenyl}-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D392-0916 |
| Compound Name: | 1-methyl-5-{2-[(3-methylphenyl)methoxy]phenyl}-2-[(prop-2-en-1-yl)sulfanyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Smiles: | Cc1cccc(COc2ccccc2C2CC(NC3=C2C(N=C(N3C)SCC=C)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.503 |
| logD: | 4.403 |
| logSw: | -4.5479 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.668 |
| InChI Key: | IZYMKLBHYKDBSP-IBGZPJMESA-N |