Products for Research Use Only
RegisterLogin

VU6007496

CAT: 0013-GTR19238595-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19238595-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
VU6007496 is a brain-penetrant, highly selective positive allosteric modulator (PAM) of the M1 muscarinic receptor with favorable pharmacokinetic properties. It is a valuable research tool for investigating M1 receptor function in both in vitro and in vivo models relevant to CNS disorders.
CAS Number
2127101-85-1
Field of Research
Neuroscience
Smiles
O=C (NC1CCOCC1) C2=NC=3C=CN (C3C (=C2) CC=4C=CC (=CC4) C5=NN (C=C5) C) C
Molecular Formula
C25H27N5O2
Molecular Weight
429.51
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-methyl-7-[[4-(1-methylpyrazol-3-yl)phenyl]methyl]-N-(oxan-4-yl)pyrrolo[3,2-b]pyridine-5-carboxamide
CAS Number2127101-85-1
PubChem CID141711336
IUPAC Name1-methyl-7-[[4-(1-methylpyrazol-3-yl)phenyl]methyl]-N-(oxan-4-yl)pyrrolo[3,2-b]pyridine-5-carboxamide
Molecular FormulaC25H27N5O2
Molecular Weight429.5
XLogP2.9
Topological Polar Surface Area74
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity634
SMILES
CN1C=CC2=C1C(=CC(=N2)C(=O)NC3CCOCC3)CC4=CC=C(C=C4)C5=NN(C=C5)C
InChI
InChI=1S/C25H27N5O2/c1-29-11-7-22-24(29)19(16-23(27-22)25(31)26-20-9-13-32-14-10-20)15-17-3-5-18(6-4-17)21-8-12-30(2)28-21/h3-8,11-12,16,20H,9-10,13-15H2,1-2H3,(H,26,31)
InChIKey
UJKNYDAANSRFNH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-methyl-7-[[4-(1-methylpyrazol-3-yl)phenyl]methyl]-N-(oxan-4-yl)pyrrolo[3,2-b]pyridine-5-carboxamide
CAS: 2127101-85-1
CID: 141711336
Formula: C25H27N5O2
MW: 429.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight429.5
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass429.21647512
Monoisotopic Mass429.21647512
Topological Polar Surface Area74 Ų
Heavy Atom Count32
Formal Charge0
Complexity634
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19210234-01VU6007477
GTR19261820-01VU6067416

Alternative Products

CatalogName
T200762-01VU6007496

Popular Products