5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D244-0325 |
| Compound Name: | 5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 437.92 |
| Molecular Formula: | C17 H16 Cl N5 O3 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)S(Cc1cccc(C)c1)(=O)=O)[Cl])=O)c1nnc(CC)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9687 |
| logD: | 0.9979 |
| logSw: | -4.1566 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.548 |
| InChI Key: | IMFAUYGMHFMKIB-UHFFFAOYSA-N |