N~3~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~1~,N~1~-dimethylpiperidine-1,3-dicarboxamide
Chemical Structure Depiction of
N~3~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~1~,N~1~-dimethylpiperidine-1,3-dicarboxamide
N~3~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~1~,N~1~-dimethylpiperidine-1,3-dicarboxamide
Compound characteristics
Compound ID: | Y032-4530 |
Compound Name: | N~3~-{5-[(butan-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-N~1~,N~1~-dimethylpiperidine-1,3-dicarboxamide |
Molecular Weight: | 371.52 |
Molecular Formula: | C15 H25 N5 O2 S2 |
Smiles: | CCC(C)Sc1nnc(NC(C2CCCN(C2)C(N(C)C)=O)=O)s1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.9541 |
logD: | 2.9404 |
logSw: | -3.198 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.975 |
InChI Key: | JCADZQUKMPNKHJ-UHFFFAOYSA-N |