4,10,16-tris(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane
Chemical Structure Depiction of
4,10,16-tris(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane
4,10,16-tris(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane
Compound characteristics
| Compound ID: | 0242-0424 |
| Compound Name: | 4,10,16-tris(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane |
| Molecular Weight: | 723.93 |
| Molecular Formula: | C33 H45 N3 O9 S3 |
| Smiles: | Cc1ccc(cc1)S(N1CCOCCN(CCOCCN(CCOCC1)S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6892 |
| logD: | 4.6892 |
| logSw: | -4.3064 |
| Hydrogen bond acceptors count: | 18 |
| Polar surface area: | 119.044 |
| InChI Key: | ZWZKIZMEFFTNEM-UHFFFAOYSA-N |