ethyl 2-(methylsulfanyl)-4-[4-(pyrrolidine-1-sulfonyl)anilino]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(methylsulfanyl)-4-[4-(pyrrolidine-1-sulfonyl)anilino]pyrimidine-5-carboxylate
ethyl 2-(methylsulfanyl)-4-[4-(pyrrolidine-1-sulfonyl)anilino]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | D278-0625 |
| Compound Name: | ethyl 2-(methylsulfanyl)-4-[4-(pyrrolidine-1-sulfonyl)anilino]pyrimidine-5-carboxylate |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C18 H22 N4 O4 S2 |
| Smiles: | CCOC(c1cnc(nc1Nc1ccc(cc1)S(N1CCCC1)(=O)=O)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4149 |
| logD: | 3.4149 |
| logSw: | -3.6996 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.436 |
| InChI Key: | JSVYXVFEBSKBJT-UHFFFAOYSA-N |