ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-1,2-dimethyl-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-1,2-dimethyl-1H-indole-3-carboxylate--hydrogen chloride (1/1)
ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-1,2-dimethyl-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 6913-0017 |
| Compound Name: | ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-1,2-dimethyl-1H-indole-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 424.97 |
| Molecular Formula: | C22 H32 N2 O4 |
| Salt: | HCl |
| Smiles: | CCOC(c1c2cc(ccc2n(C)c1C)OCC(CN1CCCCCC1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4585 |
| logD: | 2.1108 |
| logSw: | -3.7646 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.457 |
| InChI Key: | IIKRUGSPCFKOHE-KRWDZBQOSA-N |