dimethyl 2,2'-(1,7-dioxa-4,10-diazacyclododecane-4,10-diyldicarbonyl)dibenzoate
Chemical Structure Depiction of
dimethyl 2,2'-(1,7-dioxa-4,10-diazacyclododecane-4,10-diyldicarbonyl)dibenzoate
dimethyl 2,2'-(1,7-dioxa-4,10-diazacyclododecane-4,10-diyldicarbonyl)dibenzoate
Compound characteristics
| Compound ID: | 1051-0231 |
| Compound Name: | dimethyl 2,2'-(1,7-dioxa-4,10-diazacyclododecane-4,10-diyldicarbonyl)dibenzoate |
| Molecular Weight: | 498.53 |
| Molecular Formula: | C26 H30 N2 O8 |
| Smiles: | COC(c1ccccc1C(N1CCOCCN(CCOCC1)C(c1ccccc1C(=O)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1365 |
| logD: | 1.1365 |
| logSw: | -1.9855 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.839 |
| InChI Key: | FHIWMHYWQYGJKR-UHFFFAOYSA-N |