7,10,13-tris(4-methylbenzene-1-sulfonyl)-1,4-dioxa-7,10,13-triazacyclopentadecane
Chemical Structure Depiction of
7,10,13-tris(4-methylbenzene-1-sulfonyl)-1,4-dioxa-7,10,13-triazacyclopentadecane
7,10,13-tris(4-methylbenzene-1-sulfonyl)-1,4-dioxa-7,10,13-triazacyclopentadecane
Compound characteristics
| Compound ID: | 2172-0015 |
| Compound Name: | 7,10,13-tris(4-methylbenzene-1-sulfonyl)-1,4-dioxa-7,10,13-triazacyclopentadecane |
| Molecular Weight: | 679.87 |
| Molecular Formula: | C31 H41 N3 O8 S3 |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CCOCCOCCN(CC1)S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5921 |
| logD: | 4.5921 |
| logSw: | -4.28 |
| Hydrogen bond acceptors count: | 17 |
| Polar surface area: | 111.135 |
| InChI Key: | GJXAGFKDQBSFQO-UHFFFAOYSA-N |