4-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-2-ethoxyphenyl 4-chlorobenzoate
Chemical Structure Depiction of
4-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-2-ethoxyphenyl 4-chlorobenzoate
4-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-2-ethoxyphenyl 4-chlorobenzoate
Compound characteristics
| Compound ID: | D336-6956 |
| Compound Name: | 4-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-2-ethoxyphenyl 4-chlorobenzoate |
| Molecular Weight: | 461.92 |
| Molecular Formula: | C21 H20 Cl N3 O5 S |
| Smiles: | CCOc1cc(ccc1OC(c1ccc(cc1)[Cl])=O)C1N(C(C)=O)N=C(NC(C)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5967 |
| logD: | 3.5502 |
| logSw: | -4.4815 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.817 |
| InChI Key: | LCNIACLTROERCX-IBGZPJMESA-N |