N~2~-[2-(adamantan-1-yl)ethyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-[2-(adamantan-1-yl)ethyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-[2-(adamantan-1-yl)ethyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
| Compound ID: | G675-1192 |
| Compound Name: | N~2~-[2-(adamantan-1-yl)ethyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide |
| Molecular Weight: | 444.98 |
| Molecular Formula: | C22 H25 Cl N4 O2 S |
| Smiles: | C1C2CC3CC1CC(CCNC(c1nnc(C(Nc4cccc(c4)[Cl])=O)s1)=O)(C2)C3 |
| Stereo: | ACHIRAL |
| logP: | 5.0788 |
| logD: | 5.0257 |
| logSw: | -5.3941 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.122 |
| InChI Key: | JHMIPFZPOMEDHY-UHFFFAOYSA-N |