5-chloro-2-(propylsulfanyl)-N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(propylsulfanyl)-N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}pyrimidine-4-carboxamide
5-chloro-2-(propylsulfanyl)-N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0475 |
| Compound Name: | 5-chloro-2-(propylsulfanyl)-N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C18 H17 Cl N6 O3 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCCC)[Cl])=O)c1ccc(cc1)S(Nc1ncccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7756 |
| logD: | 2.0203 |
| logSw: | -3.4734 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.134 |
| InChI Key: | RUWWXQSQOVMHTO-UHFFFAOYSA-N |