2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N,N-dimethyl-N-{[(2-methylprop-2-enoyl)oxy]methyl}ethan-1-aminium--chloride (1/1)
Chemical Structure Depiction of
2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N,N-dimethyl-N-{[(2-methylprop-2-enoyl)oxy]methyl}ethan-1-aminium--chloride (1/1)
2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N,N-dimethyl-N-{[(2-methylprop-2-enoyl)oxy]methyl}ethan-1-aminium--chloride (1/1)
Compound characteristics
| Compound ID: | 6264-0459 |
| Compound Name: | 2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-N,N-dimethyl-N-{[(2-methylprop-2-enoyl)oxy]methyl}ethan-1-aminium--chloride (1/1) |
| Molecular Weight: | 425.95 |
| Molecular Formula: | C22 H32 N O5 |
| Salt: | Cl- |
| Smiles: | CC(=C)C(=O)OC[N+](C)(C)CCOC(C(C1CCCC1)(c1ccccc1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6216 |
| logD: | 3.6216 |
| logSw: | -3.5258 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.581 |
| InChI Key: | OYTNSLHNPSBHKM-QFIPXVFZSA-N |