methyl 7-methyl-4-oxo-5-[4-(propan-2-yl)phenyl]-2-(propylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-methyl-4-oxo-5-[4-(propan-2-yl)phenyl]-2-(propylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
methyl 7-methyl-4-oxo-5-[4-(propan-2-yl)phenyl]-2-(propylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C117-0636 |
| Compound Name: | methyl 7-methyl-4-oxo-5-[4-(propan-2-yl)phenyl]-2-(propylsulfanyl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Smiles: | CCCSC1NC(C2C(C(=C(C)NC=2N=1)C(=O)OC)c1ccc(cc1)C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2607 |
| logD: | 2.3435 |
| logSw: | -4.18 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.229 |
| InChI Key: | VGFKYDAJAVXQEV-QGZVFWFLSA-N |