methyl 1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | G749-0045 |
| Compound Name: | methyl 1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C22 H19 N3 O3 S2 |
| Smiles: | Cc1ccccc1CSC1=NC(c2c(cc(c3cccs3)nc2N1C)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4138 |
| logD: | 5.4137 |
| logSw: | -5.4673 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.365 |
| InChI Key: | AJAPIKFHJYWXTC-UHFFFAOYSA-N |