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Chemical structure of Nicotinoyl cyclandelate

GC36741

Nicotinoyl cyclandelate

Also known as [2-oxo-1-phenyl-2-(3,3,5-trimethylcyclohexyl)oxyethyl] pyridine-3-carboxylate

Nicotinoyl cyclandelate can be used to lower the perfusion pressure of cerebral blood vessels and the blood pressure of femoral artery

ChemicalCAS39537-99-0MW381.46FormulaC23H27NO4
CAS number
39537-99-0
Molecular weight
381.46
Formula
C23H27NO4
Solubility
Soluble in DMSO
InChIKey
JVISQUVIQOJOOQ-UHFFFAOYSA-N
Catalogue number
GC36741
Brand
GLPBIO
Computed properties PubChem CID 172291 · XLogP 5.4 · TPSA 65.5 Ų · H-bond donors 0
XLogP
5.4
TPSA
65.5 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
28

SMILES CC1CC(CC(C1)(C)C)OC(=O)C(C2=CC=CC=C2)OC(=O)C3=CN=CC=C3

Computed descriptors from PubChem (CID 172291), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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