N-(4-acetyl-5-{3-methoxy-4-[2-(phenylsulfanyl)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(4-acetyl-5-{3-methoxy-4-[2-(phenylsulfanyl)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
N-(4-acetyl-5-{3-methoxy-4-[2-(phenylsulfanyl)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D336-6792 |
| Compound Name: | N-(4-acetyl-5-{3-methoxy-4-[2-(phenylsulfanyl)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C21 H23 N3 O4 S2 |
| Smiles: | CC(NC1=NN(C(c2ccc(c(c2)OC)OCCSc2ccccc2)S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2219 |
| logD: | 3.1754 |
| logSw: | -3.4926 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.006 |
| InChI Key: | YELGGMRUBAFBJZ-FQEVSTJZSA-N |