5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(propylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0561 |
| Compound Name: | 5-chloro-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(propylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 375.92 |
| Molecular Formula: | C12 H14 Cl N5 O S3 |
| Smiles: | CCCSc1ncc(c(C(Nc2nnc(SCC)s2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5138 |
| logD: | 3.8876 |
| logSw: | -4.4525 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.821 |
| InChI Key: | RUJRQZQJTUSCPA-UHFFFAOYSA-N |