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Chemical structure of A-1165442

GC30837

A-1165442

Also known as 1-[(4R)-7-chloro-2,2-bis(fluoromethyl)-3,4-dihydrochromen-4-yl]-3-(3-methylisoquinolin-5-yl)urea

A-1165442 is a potent, competitive and orally available TRPV1 antagonist with an IC50 of 9 nM for human TRPV1

ChemicalCAS1221443-94-2MW431.86FormulaC22H20ClF2N3O2
CAS number
1221443-94-2
Molecular weight
431.86
Formula
C22H20ClF2N3O2
Solubility
DMSO ： ≥ 100 mg/mL (231·56 mM)
InChIKey
VJJGAJAUECQWSZ-LJQANCHMSA-N
Catalogue number
GC30837
Brand
GLPBIO
Computed properties PubChem CID 46191567 · XLogP 4.3 · TPSA 63.3 Ų · H-bond donors 2
XLogP
4.3
TPSA
63.3 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
30

SMILES CC1=CC2=C(C=CC=C2NC(=O)N[C@@H]3CC(OC4=C3C=CC(=C4)Cl)(CF)CF)C=N1

Computed descriptors from PubChem (CID 46191567), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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