N-(4-acetyl-5-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(4-acetyl-5-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
N-(4-acetyl-5-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D336-6634 |
| Compound Name: | N-(4-acetyl-5-{4-[2-(4-chloro-3-methylphenoxy)ethoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C21 H22 Cl N3 O4 S |
| Smiles: | CC(NC1=NN(C(c2ccc(cc2)OCCOc2ccc(c(C)c2)[Cl])S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5062 |
| logD: | 4.4597 |
| logSw: | -4.6437 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.706 |
| InChI Key: | KVRBQQJAQKZLAN-FQEVSTJZSA-N |