5-chloro-N-[4-(2,6-dimethylmorpholine-4-sulfonyl)phenyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[4-(2,6-dimethylmorpholine-4-sulfonyl)phenyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-[4-(2,6-dimethylmorpholine-4-sulfonyl)phenyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0483 |
| Compound Name: | 5-chloro-N-[4-(2,6-dimethylmorpholine-4-sulfonyl)phenyl]-2-(propylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 485.02 |
| Molecular Formula: | C20 H25 Cl N4 O4 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCCC)[Cl])=O)c1ccc(cc1)S(N1CC(C)OC(C)C1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5924 |
| logD: | 3.3629 |
| logSw: | -3.8103 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.558 |
| InChI Key: | CHNIQWINVIPUAO-UHFFFAOYSA-N |