TC LPA5 4

CAT: 1410-M33938-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:1410-M33938-01Size:5 mg

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Description

TC LPA5 4 is a LPA5 receptor antagonist.

CAS Number

1393814-38-4

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

410.89

Molecular Formula

C23H23ClN2O3

Notes

Research use only, not for human use.

Receptor

LPA Receptor

Chemical Information

TC Lpa5 4

CAS Number	1393814-38-4
PubChem CID	66552906
IUPAC Name	5-(3-chloro-4-cyclohexylphenyl)-1-(3-methoxyphenyl)pyrazole-3-carboxylic acid
Molecular Formula	C23H23ClN2O3
Molecular Weight	410.9
XLogP	6.5
Topological Polar Surface Area	64.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	29
Formal Charge	0
Complexity	556

SMILES

COC1=CC=CC(=C1)N2C(=CC(=N2)C(=O)O)C3=CC(=C(C=C3)C4CCCCC4)Cl

InChI

InChI=1S/C23H23ClN2O3/c1-29-18-9-5-8-17(13-18)26-22(14-21(25-26)23(27)28)16-10-11-19(20(24)12-16)15-6-3-2-4-7-15/h5,8-15H,2-4,6-7H2,1H3,(H,27,28)

InChIKey

BNALUYKEGYUHQC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1393814-38-4

CID: 66552906

Formula: C23H23ClN2O3

MW: 410.9

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	410.9
XLogP3	6.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	410.1397203
Monoisotopic Mass	410.1397203
Topological Polar Surface Area	64.4 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	556
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

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Alternative Products

Catalog	Name
551026	LPA5-IN-4
TFC81438-01	TC LPA5 4
T63231-01	LPA5 antagonist 1
T63172-01	LPA5 antagonist 2
GTR19235034-01	LPA5 antagonist 3
NLS426	Rabbit Polyclonal LPAR5/LPA5/GPR92 Antibody

TC LPA5 4

Chemical Information

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