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Chemical structure of Ro 10-5824 dihydrochloride

GC12428

Ro 10-5824 dihydrochloride

Also known as 2-methyl-5-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]pyrimidin-4-amine;dihydrochloride

dopamine D4 receptor partial agonist

ChemicalCAS189744-94-3MW353.29FormulaC17H20N4·2HCl
CAS number
189744-94-3
Molecular weight
353.29
Formula
C17H20N4·2HCl
Solubility
H2O : 100 mg/mL (283·05 mM; Need ultrasonic); DMSO : 8·33 mg/mL (23·58 mM; Need ultrasonic)
InChIKey
UZHMRJRDYCRKIZ-UHFFFAOYSA-N
Catalogue number
GC12428
Brand
GLPBIO
Computed properties PubChem CID 16759174 · TPSA 55 Ų · H-bond donors 3 · H-bond acceptors 4
TPSA
55 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23

SMILES CC1=NC=C(C(=N1)N)CN2CCC(=CC2)C3=CC=CC=C3.Cl.Cl

Computed descriptors from PubChem (CID 16759174), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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