ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate--hydrogen chloride (1/1)
ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5936-0095 |
| Compound Name: | ethyl 5-[3-(azepan-1-yl)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 501.07 |
| Molecular Formula: | C28 H36 N2 O4 |
| Salt: | HCl |
| Smiles: | CCOC(c1c2cc(ccc2n(c2ccc(C)cc2)c1C)OCC(CN1CCCCCC1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5113 |
| logD: | 4.1635 |
| logSw: | -5.3065 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.118 |
| InChI Key: | ILLZANSUCOVAMF-QHCPKHFHSA-N |