2~1~-[(2-chlorophenyl)methyl]-1~1~,3~1~-dimethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Chemical Structure Depiction of
2~1~-[(2-chlorophenyl)methyl]-1~1~,3~1~-dimethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
2~1~-[(2-chlorophenyl)methyl]-1~1~,3~1~-dimethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Compound characteristics
| Compound ID: | Y505-6939 |
| Compound Name: | 2~1~-[(2-chlorophenyl)methyl]-1~1~,3~1~-dimethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole |
| Molecular Weight: | 352.82 |
| Molecular Formula: | C18 H17 Cl N6 |
| Smiles: | Cn1cc(cn1)c1cc(c2cnn(C)c2)n(Cc2ccccc2[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5179 |
| logD: | 2.5179 |
| logSw: | -3.1888 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 42.272 |
| InChI Key: | HMBUSHQFIWBKBM-UHFFFAOYSA-N |