LXR-623 50mg

CAT: 0628-A21366-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A21366-50Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

875787-07-8

Chemical Information

Lxr-623

LX-623 is an organic molecular entity. It has a role as a liver X receptor agonist.

CAS Number	875787-07-8
PubChem CID	16734800
IUPAC Name	2-[(2-chloro-4-fluorophenyl)methyl]-3-(4-fluorophenyl)-7-(trifluoromethyl)indazole
Molecular Formula	C21H12ClF5N2
Molecular Weight	422.8
XLogP	6.5
Topological Polar Surface Area	17.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	29
Formal Charge	0
Complexity	554

SMILES

C1=CC2=C(N(N=C2C(=C1)C(F)(F)F)CC3=C(C=C(C=C3)F)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H12ClF5N2/c22-18-10-15(24)9-6-13(18)11-29-20(12-4-7-14(23)8-5-12)16-2-1-3-17(19(16)28-29)21(25,26)27/h1-10H,11H2

InChIKey

KYWWJENKIMRJBI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 875787-07-8

CID: 16734800

Formula: C21H12ClF5N2

MW: 422.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	422.8
XLogP3	6.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	422.0609169
Monoisotopic Mass	422.0609169
Topological Polar Surface Area	17.8 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	554
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes