5-chloro-2-(ethylsulfanyl)-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-(ethylsulfanyl)-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide
5-chloro-2-(ethylsulfanyl)-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D054-0328 |
Compound Name: | 5-chloro-2-(ethylsulfanyl)-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide |
Molecular Weight: | 375.92 |
Molecular Formula: | C12 H14 Cl N5 O S3 |
Smiles: | [H]N(C(c1c(cnc(n1)SCC)[Cl])=O)c1nnc(SCCC)s1 |
Stereo: | ACHIRAL |
logP: | 4.4997 |
logD: | 3.8735 |
logSw: | -4.4583 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.821 |
InChI Key: | WFNNWCLMVRPBHF-UHFFFAOYSA-N |