5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D271-0682 |
| Compound Name: | 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C24 H23 N3 O4 S |
| Smiles: | Cc1ccccc1CSC1=NC(C2C(CC(NC=2N1C)=O)c1ccc2c(c1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6965 |
| logD: | 2.5964 |
| logSw: | -3.0509 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.905 |
| InChI Key: | RHDLUUMTXGOFCS-KRWDZBQOSA-N |