1,4,7-tris(4-methylbenzene-1-sulfonyl)-1,4,7-triazonane
Chemical Structure Depiction of
1,4,7-tris(4-methylbenzene-1-sulfonyl)-1,4,7-triazonane
1,4,7-tris(4-methylbenzene-1-sulfonyl)-1,4,7-triazonane
Compound characteristics
| Compound ID: | 0177-0010 |
| Compound Name: | 1,4,7-tris(4-methylbenzene-1-sulfonyl)-1,4,7-triazonane |
| Molecular Weight: | 591.77 |
| Molecular Formula: | C27 H33 N3 O6 S3 |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CCN(CC1)S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8058 |
| logD: | 4.8058 |
| logSw: | -4.5355 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 95.318 |
| InChI Key: | BLZOXONTWBENEK-UHFFFAOYSA-N |