ethyl 2-(methylsulfanyl)-4-{4-[(pyridin-2-yl)sulfamoyl]anilino}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(methylsulfanyl)-4-{4-[(pyridin-2-yl)sulfamoyl]anilino}pyrimidine-5-carboxylate
ethyl 2-(methylsulfanyl)-4-{4-[(pyridin-2-yl)sulfamoyl]anilino}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | D278-0581 |
| Compound Name: | ethyl 2-(methylsulfanyl)-4-{4-[(pyridin-2-yl)sulfamoyl]anilino}pyrimidine-5-carboxylate |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C19 H19 N5 O4 S2 |
| Smiles: | CCOC(c1cnc(nc1Nc1ccc(cc1)S(Nc1ccccn1)(=O)=O)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3762 |
| logD: | 3.2227 |
| logSw: | -3.6602 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.624 |
| InChI Key: | MPBFOTOQLRGOMQ-UHFFFAOYSA-N |