5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine-4-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine-4-carbonyl]-1,5-diazacycloundecan-2-one
5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine-4-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
Compound ID: | S790-0137 |
Compound Name: | 5-[1-(1-ethyl-1H-pyrazole-3-carbonyl)piperidine-4-carbonyl]-1,5-diazacycloundecan-2-one |
Molecular Weight: | 403.52 |
Molecular Formula: | C21 H33 N5 O3 |
Smiles: | CCn1ccc(C(N2CCC(CC2)C(N2CCCCCCNC(CC2)=O)=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 0.2281 |
logD: | 0.2281 |
logSw: | -1.5798 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.275 |
InChI Key: | SDHYPLGVIOFTTR-UHFFFAOYSA-N |