ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/2)
Chemical Structure Depiction of
ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/2)
ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/2)
Compound characteristics
Compound ID: | 8013-6119 |
Compound Name: | ethyl 1-butyl-5-hydroxy-2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1H-indole-3-carboxylate--hydrogen chloride (1/2) |
Molecular Weight: | 460.44 |
Molecular Formula: | C22 H33 N3 O3 |
Salt: | 2HCl |
Smiles: | CCCCn1c(C)c(C(=O)OCC)c2c(CN3CCN(C)CC3)c(ccc12)O |
Stereo: | ACHIRAL |
logP: | 3.3209 |
logD: | 2.5219 |
logSw: | -3.493 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.2 |
InChI Key: | UJWSRLRJLUNLAT-UHFFFAOYSA-N |