benzyl 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7-carboxylate
Chemical Structure Depiction of
benzyl 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7-carboxylate
benzyl 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7-carboxylate
Compound characteristics
| Compound ID: | 0242-0509 |
| Compound Name: | benzyl 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7-carboxylate |
| Molecular Weight: | 396.48 |
| Molecular Formula: | C20 H32 N2 O6 |
| Smiles: | C1COCCOCCN(CCOCCOCCN1)C(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 0.8152 |
| logD: | -0.29 |
| logSw: | -1.4172 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.24 |
| InChI Key: | IKQUTECSTHBOCT-UHFFFAOYSA-N |