N~2~-[3-(azepan-1-yl)butyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-[3-(azepan-1-yl)butyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-[3-(azepan-1-yl)butyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
| Compound ID: | G675-1267 |
| Compound Name: | N~2~-[3-(azepan-1-yl)butyl]-N~5~-(3-chlorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide |
| Molecular Weight: | 435.97 |
| Molecular Formula: | C20 H26 Cl N5 O2 S |
| Smiles: | CC(CCNC(c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O)N1CCCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4476 |
| logD: | 0.5152 |
| logSw: | -3.8196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.06 |
| InChI Key: | BBCBSGBURMEBLB-AWEZNQCLSA-N |