N-[5-(heptan-3-yl)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[5-(heptan-3-yl)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
N-[5-(heptan-3-yl)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | 1593-0369 |
| Compound Name: | N-[5-(heptan-3-yl)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide |
| Molecular Weight: | 317.45 |
| Molecular Formula: | C17 H23 N3 O S |
| Smiles: | CCCCC(CC)c1nnc(NC(c2ccc(C)cc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4179 |
| logD: | 4.6124 |
| logSw: | -5.2781 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.875 |
| InChI Key: | KBLPOCHOQURUTO-ZDUSSCGKSA-N |