5-chloro-N-[4-(2-ethylpiperidine-1-sulfonyl)phenyl]-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[4-(2-ethylpiperidine-1-sulfonyl)phenyl]-2-(ethylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-[4-(2-ethylpiperidine-1-sulfonyl)phenyl]-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0313 |
| Compound Name: | 5-chloro-N-[4-(2-ethylpiperidine-1-sulfonyl)phenyl]-2-(ethylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 469.02 |
| Molecular Formula: | C20 H25 Cl N4 O3 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1ccc(cc1)S(N1CCCCC1CC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6406 |
| logD: | 4.4111 |
| logSw: | -4.5886 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.049 |
| InChI Key: | ZQHYJODNNKUUFL-HNNXBMFYSA-N |