N-(4-acetyl-5-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(4-acetyl-5-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
N-(4-acetyl-5-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D336-6269 |
| Compound Name: | N-(4-acetyl-5-{3-chloro-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 491.99 |
| Molecular Formula: | C23 H26 Cl N3 O5 S |
| Smiles: | CC(NC1=NN(C(c2cc(c(c(c2)[Cl])OCCOc2ccc(C)c(C)c2)OC)S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7763 |
| logD: | 4.7298 |
| logSw: | -4.9 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.51 |
| InChI Key: | LFBHCUWHDZIVHW-QFIPXVFZSA-N |