ethyl 2,5-dimethyl-1-[2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5-dimethyl-1-[2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-1H-pyrrole-3-carboxylate
ethyl 2,5-dimethyl-1-[2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | S766-0120 |
| Compound Name: | ethyl 2,5-dimethyl-1-[2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C18 H27 N3 O5 |
| Smiles: | CCOC(c1cc(C)n(CC(N2CCC(NCCOCC2)=O)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0389 |
| logD: | 0.0389 |
| logSw: | -1.7139 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.569 |
| InChI Key: | VKQQNIDSKLCDDD-UHFFFAOYSA-N |