3-{[(3-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Chemical Structure Depiction of
3-{[(3-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3]benzothiazole
3-{[(3-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Compound characteristics
| Compound ID: | 8013-3221 |
| Compound Name: | 3-{[(3-chlorophenyl)methyl]sulfanyl}[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
| Molecular Weight: | 331.84 |
| Molecular Formula: | C15 H10 Cl N3 S2 |
| Smiles: | C(c1cccc(c1)[Cl])Sc1nnc2n1c1ccccc1s2 |
| Stereo: | ACHIRAL |
| logP: | 4.6885 |
| logD: | 4.6885 |
| logSw: | -4.9125 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.3067 |
| InChI Key: | SDDUHCYWAFDZNV-UHFFFAOYSA-N |