11-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-7-(2-methylpropyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one
Chemical Structure Depiction of
11-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-7-(2-methylpropyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one
11-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-7-(2-methylpropyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one
Compound characteristics
Compound ID: | SB80-0344 |
Compound Name: | 11-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-7-(2-methylpropyl)-7,11,14-triazaspiro[5.10]hexadecan-15-one |
Molecular Weight: | 417.64 |
Molecular Formula: | C24 H43 N5 O |
Smiles: | CCn1c(C)c(CN2CCCN(CC(C)C)C3(CCCCC3)CC(NCC2)=O)cn1 |
Stereo: | ACHIRAL |
logP: | 2.8262 |
logD: | -1.2096 |
logSw: | -2.9861 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.629 |
InChI Key: | HMZXHKOXGQGQAB-UHFFFAOYSA-N |