2~1~-(5-bromothiophene-2-sulfonyl)-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~-(5-bromothiophene-2-sulfonyl)-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~-(5-bromothiophene-2-sulfonyl)-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: | Y505-6897 |
| Compound Name: | 2~1~-(5-bromothiophene-2-sulfonyl)-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: | 481.39 |
| Molecular Formula: | C17 H17 Br N6 O2 S2 |
| Smiles: | Cc1c(cn(C)n1)c1cc(c2cn(C)nc2C)n(n1)S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.284 |
| logD: | 2.284 |
| logSw: | -2.6477 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.335 |
| InChI Key: | YSZKBWDEUWPJLK-UHFFFAOYSA-N |