1-benzyl-4,7,10-tris(4-methylbenzene-1-sulfonyl)-1,4,7,10-tetraazacyclododecane
Chemical Structure Depiction of
1-benzyl-4,7,10-tris(4-methylbenzene-1-sulfonyl)-1,4,7,10-tetraazacyclododecane
1-benzyl-4,7,10-tris(4-methylbenzene-1-sulfonyl)-1,4,7,10-tetraazacyclododecane
Compound characteristics
| Compound ID: | 0495-0015 |
| Compound Name: | 1-benzyl-4,7,10-tris(4-methylbenzene-1-sulfonyl)-1,4,7,10-tetraazacyclododecane |
| Molecular Weight: | 724.96 |
| Molecular Formula: | C36 H44 N4 O6 S3 |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CCN(CCN(CC1)S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.159 |
| logD: | 6.1589 |
| logSw: | -5.6706 |
| Hydrogen bond acceptors count: | 16 |
| Polar surface area: | 98.858 |
| InChI Key: | OZWGNPVYVRIYRI-UHFFFAOYSA-N |