2~1~-(4-chlorobenzene-1-sulfonyl)-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~-(4-chlorobenzene-1-sulfonyl)-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~-(4-chlorobenzene-1-sulfonyl)-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: | Y505-6945 |
| Compound Name: | 2~1~-(4-chlorobenzene-1-sulfonyl)-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: | 402.86 |
| Molecular Formula: | C17 H15 Cl N6 O2 S |
| Smiles: | Cn1cc(cn1)c1cc(c2cnn(C)c2)n(n1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0415 |
| logD: | 2.0415 |
| logSw: | -2.6982 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.61 |
| InChI Key: | NFQOGQBPIKUWHK-UHFFFAOYSA-N |