HQL-79

CAT: 0013-GTR19203782-01Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19203782-01Size:2 mg

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Description

HQL-79 is a potent, selective, and orally bioavailable inhibitor of human hematopoietic prostaglandin D synthase (H-PGDS), exhibiting anti-allergic activity by suppressing PGD2 synthesis (Kd: 0.8 μM, IC50: 6 μM) . It is a valuable research tool for studying allergic and inflammatory mechanisms in both cellular and animal models, showing high selectivity over COX-1, COX-2, m-PGES, and L-PGDS.

CAS Number

162641-16-9

Field of Research

Immunology & Inflammation

Smiles

C (CN1CCC (CC1) OC (c1ccccc1) c1ccccc1) Cc1nnn[nH]1

Molecular Formula

C22H27N5O

Molecular Weight

377.48

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Hql-79

CAS Number	162641-16-9
PubChem CID	6540277
IUPAC Name	4-benzhydryloxy-1-[3-(2H-tetrazol-5-yl)propyl]piperidine
Molecular Formula	C22H27N5O
Molecular Weight	377.5
XLogP	3.8
Topological Polar Surface Area	66.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Heavy Atom Count	28
Formal Charge	0
Complexity	413

SMILES

C1CN(CCC1OC(C2=CC=CC=C2)C3=CC=CC=C3)CCCC4=NNN=N4

InChI

InChI=1S/C22H27N5O/c1-3-8-18(9-4-1)22(19-10-5-2-6-11-19)28-20-13-16-27(17-14-20)15-7-12-21-23-25-26-24-21/h1-6,8-11,20,22H,7,12-17H2,(H,23,24,25,26)

InChIKey

TZQGXAHOROZEKN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 162641-16-9

CID: 6540277

Formula: C22H27N5O

MW: 377.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	377.5
XLogP3	3.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	8
Exact Mass	377.22156050
Monoisotopic Mass	377.22156050
Topological Polar Surface Area	66.9 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	413
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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GTR19263133-01	NLRP3-IN-79
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GTR19230562-01	EGFR-IN-79
GTR19235155-01	HSD17B13-IN-79
GTR19200160-01	JYL-79

Alternative Products

Catalog	Name
MBS5754971	HQL-79
B7421-50	HQL 79
A12992-5	HQL-79 5mg
A12992-10	HQL-79 10mg
A12992-2	HQL-79 2mg
A12992-100	HQL-79 100mg
A12992-25	HQL-79 25mg
A12992-50	HQL-79 50mg
sc-19602	MECA-79 (MECA-79)
sc-19602 L	MECA-79 (MECA-79) L

HQL-79

Chemical Information

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