N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 8009-5518 |
| Compound Name: | N-[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide |
| Molecular Weight: | 331.39 |
| Molecular Formula: | C16 H17 N3 O3 S |
| Smiles: | C1CCC(CC1)C(Nc1nnc(c2ccc3c(c2)OCO3)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9163 |
| logD: | 3.9155 |
| logSw: | -3.9853 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.911 |
| InChI Key: | VAPCFQKKYGSKDC-UHFFFAOYSA-N |