ethyl 2-({[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3(2H)-yl]methyl}amino)benzoate
Chemical Structure Depiction of
ethyl 2-({[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3(2H)-yl]methyl}amino)benzoate
ethyl 2-({[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3(2H)-yl]methyl}amino)benzoate
Compound characteristics
| Compound ID: | 8009-7661 |
| Compound Name: | ethyl 2-({[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3(2H)-yl]methyl}amino)benzoate |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | CCOC(c1ccccc1NCN1C(OC(c2ccc(cc2)C(C)(C)C)=N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1316 |
| logD: | 6.1316 |
| logSw: | -5.5196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.404 |
| InChI Key: | JELFBSCVERDFPS-UHFFFAOYSA-N |