3-[(4-chlorophenyl)sulfanyl]-2-(dodecylsulfanyl)-5-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]benzene-1,4-diol
Chemical Structure Depiction of
3-[(4-chlorophenyl)sulfanyl]-2-(dodecylsulfanyl)-5-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]benzene-1,4-diol
3-[(4-chlorophenyl)sulfanyl]-2-(dodecylsulfanyl)-5-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]benzene-1,4-diol
Compound characteristics
| Compound ID: | 0104-0082 |
| Compound Name: | 3-[(4-chlorophenyl)sulfanyl]-2-(dodecylsulfanyl)-5-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]benzene-1,4-diol |
| Molecular Weight: | 629.31 |
| Molecular Formula: | C31 H37 Cl N4 O2 S3 |
| Smiles: | CCCCCCCCCCCCSc1c(cc(c(c1Sc1ccc(cc1)[Cl])O)Sc1nnnn1c1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 11.4219 |
| logD: | 11.4131 |
| logSw: | -6.1592 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.645 |
| InChI Key: | DFEMBCDNSOJVTO-UHFFFAOYSA-N |