N~2~-[3-(azepan-1-yl)butyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-[3-(azepan-1-yl)butyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-[3-(azepan-1-yl)butyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
| Compound ID: | G675-0294 |
| Compound Name: | N~2~-[3-(azepan-1-yl)butyl]-N~5~-(4-methoxyphenyl)-1,3,4-thiadiazole-2,5-dicarboxamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C21 H29 N5 O3 S |
| Smiles: | CC(CCNC(c1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O)N1CCCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6764 |
| logD: | -0.256 |
| logSw: | -3.1788 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.604 |
| InChI Key: | STIRUTFXWWGONF-HNNXBMFYSA-N |