16-(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-3,11-dione
Chemical Structure Depiction of
16-(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-3,11-dione
16-(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-3,11-dione
Compound characteristics
| Compound ID: | 4470-0774 |
| Compound Name: | 16-(4-methylbenzene-1-sulfonyl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-3,11-dione |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C19 H29 N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(N1CCOCC(NCCOCCNC(COCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.0046 |
| logD: | -1.0046 |
| logSw: | -2.1768 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.049 |
| InChI Key: | BBSLHFGFTRBGNX-UHFFFAOYSA-N |