4-({[5-(4-CHLOROPHENYL)-4-PHENYL-4H-124-TRIAZOL-3-YL]SULFANYL}METHYL)-2LAMBDA413-BENZOTHIADIAZOLE
Chemical Structure Depiction of
4-({[5-(4-CHLOROPHENYL)-4-PHENYL-4H-124-TRIAZOL-3-YL]SULFANYL}METHYL)-2LAMBDA413-BENZOTHIADIAZOLE
4-({[5-(4-CHLOROPHENYL)-4-PHENYL-4H-124-TRIAZOL-3-YL]SULFANYL}METHYL)-2LAMBDA413-BENZOTHIADIAZOLE
Compound characteristics
| Compound ID: | 8016-1821 |
| Compound Name: | 4-({[5-(4-CHLOROPHENYL)-4-PHENYL-4H-124-TRIAZOL-3-YL]SULFANYL}METHYL)-2LAMBDA413-BENZOTHIADIAZOLE |
| Molecular Weight: | 435.96 |
| Molecular Formula: | C21 H14 Cl N5 S2 |
| Smiles: | C(c1cccc2c1N=S=N2)Sc1nnc(c2ccc(cc2)[Cl])n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9686 |
| logD: | 5.9686 |
| logSw: | -6.4305 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.431 |
| InChI Key: | NYJKGADASWYEDX-UHFFFAOYSA-N |