2~1~-(benzenesulfonyl)-1~1~,1~3~,3~1~,3~3~-tetramethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Chemical Structure Depiction of
2~1~-(benzenesulfonyl)-1~1~,1~3~,3~1~,3~3~-tetramethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
2~1~-(benzenesulfonyl)-1~1~,1~3~,3~1~,3~3~-tetramethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Compound characteristics
| Compound ID: | Y505-6952 |
| Compound Name: | 2~1~-(benzenesulfonyl)-1~1~,1~3~,3~1~,3~3~-tetramethyl-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C19 H20 N6 O2 S |
| Smiles: | Cc1c(cn(C)n1)c1cc(c2cn(C)nc2C)n(n1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5397 |
| logD: | 1.5397 |
| logSw: | -2.4132 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.316 |
| InChI Key: | YGQKPBKOJOFGDF-UHFFFAOYSA-N |