methyl 2-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-1-methyl-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 2-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-1-methyl-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 2-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-1-methyl-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | G749-0050 |
| Compound Name: | methyl 2-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-1-methyl-4-oxo-7-(thiophen-2-yl)-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C24 H22 N4 O4 S2 |
| Smiles: | Cc1cccc(c1C)NC(CSC1=NC(c2c(cc(c3cccs3)nc2N1C)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.642 |
| logD: | 4.642 |
| logSw: | -4.5532 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.817 |
| InChI Key: | MEHKZVFCRQMFLM-UHFFFAOYSA-N |