VU0483605

CAT: 1410-M27457-04Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1410-M27457-04Size:10 mg

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

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Description

VU0483605 is an effective and selective positive allosteric modulator of mGluR1 with EC50s of 390 and 356 nM for human and rat, respectively.

CAS Number

1623101-11-0

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

446.67

Molecular Formula

C20H10Cl3N3O3

Notes

Research use only, not for human use.

Receptor

TRPV1

Chemical Information

3-Chloro-N-(3-chloro-4-(4-chloro-1,3-dioxoisoindolin-2-yl)phenyl)picolinamide

CAS Number	1623101-11-0
PubChem CID	91885483
IUPAC Name	3-chloro-N-[3-chloro-4-(4-chloro-1,3-dioxoisoindol-2-yl)phenyl]pyridine-2-carboxamide
Molecular Formula	C20H10Cl3N3O3
Molecular Weight	446.7
XLogP	4.4
Topological Polar Surface Area	79.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	29
Formal Charge	0
Complexity	679

SMILES

C1=CC2=C(C(=C1)Cl)C(=O)N(C2=O)C3=C(C=C(C=C3)NC(=O)C4=C(C=CC=N4)Cl)Cl

InChI

InChI=1S/C20H10Cl3N3O3/c21-12-4-1-3-11-16(12)20(29)26(19(11)28)15-7-6-10(9-14(15)23)25-18(27)17-13(22)5-2-8-24-17/h1-9H,(H,25,27)

InChIKey

HJQXPBKPTGWZCF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1623101-11-0

CID: 91885483

Formula: C20H10Cl3N3O3

MW: 446.7

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	446.7
XLogP3	4.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	444.978774
Monoisotopic Mass	444.978774
Topological Polar Surface Area	79.4 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	679
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

Catalog	Name
C5611-10	VU0483605