methyl 2-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)benzoate
Chemical Structure Depiction of
methyl 2-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)benzoate
methyl 2-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)benzoate
Compound characteristics
| Compound ID: | 1051-0222 |
| Compound Name: | methyl 2-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)benzoate |
| Molecular Weight: | 337.37 |
| Molecular Formula: | C17 H23 N O6 |
| Smiles: | COC(c1ccccc1C(N1CCOCCOCCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3369 |
| logD: | 0.3369 |
| logSw: | -1.9554 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.117 |
| InChI Key: | JVEULCRPFMLDSE-UHFFFAOYSA-N |