N-(2-ethylphenyl)-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
N-(2-ethylphenyl)-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | C885-4633 |
Compound Name: | N-(2-ethylphenyl)-1-(5-oxo-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)piperidine-4-carboxamide |
Molecular Weight: | 425.55 |
Molecular Formula: | C22 H27 N5 O2 S |
Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N1CCC(CC1)C(Nc1ccccc1CC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8487 |
logD: | 3.8454 |
logSw: | -3.7213 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.971 |
InChI Key: | IXZSICGNRBXPDX-UHFFFAOYSA-N |