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PQ-10

CAT: 0931-T24656-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T24656-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
927691-21-2
Target
PDE
Related Pathways
Metabolism
Purity
0.9986
Bioactivity
PQ-10 (A-844337) is a PDE-10 inhibitor. PQ-10 induces brain glucose metabolism patterns, which may be a potential translational biomarker.
Smiles
COc1cc2ncnc(N3CCC(C3)Oc3cnc4ccccc4n3)c2cc1OC
Molecular Formula
C22H21N5O3
Molecular Weight
403.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

PQ-10
CAS Number927691-21-2
PubChem CID11955614
IUPAC Name6,7-dimethoxy-4-[(3R)-3-quinoxalin-2-yloxypyrrolidin-1-yl]quinazoline
Molecular FormulaC22H21N5O3
Molecular Weight403.4
XLogP3.4
Topological Polar Surface Area82.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity569
SMILES
COC1=C(C=C2C(=C1)C(=NC=N2)N3CC[C@H](C3)OC4=NC5=CC=CC=C5N=C4)OC
InChI
InChI=1S/C22H21N5O3/c1-28-19-9-15-18(10-20(19)29-2)24-13-25-22(15)27-8-7-14(12-27)30-21-11-23-16-5-3-4-6-17(16)26-21/h3-6,9-11,13-14H,7-8,12H2,1-2H3/t14-/m1/s1
InChIKey
UBIIFKJMNRPNMT-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of PQ-10
CAS: 927691-21-2
CID: 11955614
Formula: C22H21N5O3
MW: 403.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight403.4
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass403.16443955
Monoisotopic Mass403.16443955
Topological Polar Surface Area82.5 Ų
Heavy Atom Count30
Formal Charge0
Complexity569
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes