2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N,N-dimethylethan-1-aminium
Chemical Structure Depiction of
2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N,N-dimethylethan-1-aminium
2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N,N-dimethylethan-1-aminium
Compound characteristics
| Compound ID: | 4364-0161 |
| Compound Name: | 2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N,N-dimethylethan-1-aminium |
| Molecular Weight: | 438.95 |
| Molecular Formula: | C22 H31 N2 O5 |
| Salt: | Cl- |
| Smiles: | C[N+](C)(CCOC(C(C1CCCC1)(c1ccccc1)O)=O)CN1C(CCC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.956 |
| logD: | 1.956 |
| logSw: | -1.9711 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.478 |
| InChI Key: | MNRUYZPLVHJDTJ-QFIPXVFZSA-N |