3-[(4-chlorophenyl)methyl]quinoxaline-2-thiol
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]quinoxaline-2-thiol
3-[(4-chlorophenyl)methyl]quinoxaline-2-thiol
Compound characteristics
| Compound ID: | C066-5382 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]quinoxaline-2-thiol |
| Molecular Weight: | 286.78 |
| Molecular Formula: | C15 H11 Cl N2 S |
| Smiles: | C(c1ccc(cc1)[Cl])c1c(nc2ccccc2n1)S |
| Stereo: | ACHIRAL |
| logP: | 4.2252 |
| logD: | 2.7788 |
| logSw: | -4.5604 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 17.7353 |
| InChI Key: | ZPUBQANGVHBOKZ-UHFFFAOYSA-N |