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CQ

CAT: 0931-T71765-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T71765-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
7455-77-8
Target
Others
Related Pathways
Others
Bioactivity
CQ is a potent inhibitor of alpha-glucosidase
Smiles
OC1=NC(=NC2=CC=CC=C12)C1=CC=C(Cl)C=C1
Molecular Formula
C14H9ClN2O
Molecular Weight
256.69
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-(4-Chlorophenyl)quinazolin-4-ol
CAS Number7455-77-8
PubChem CID135404247
IUPAC Name2-(4-chlorophenyl)-3H-quinazolin-4-one
Molecular FormulaC14H9ClN2O
Molecular Weight256.68
XLogP3
Topological Polar Surface Area41.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity361
SMILES
C1=CC=C2C(=C1)C(=O)NC(=N2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C14H9ClN2O/c15-10-7-5-9(6-8-10)13-16-12-4-2-1-3-11(12)14(18)17-13/h1-8H,(H,16,17,18)
InChIKey
AKHUKZJZNGHOJU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Chlorophenyl)quinazolin-4-ol
CAS: 7455-77-8
CID: 135404247
Formula: C14H9ClN2O
MW: 256.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.68
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass256.0403406
Monoisotopic Mass256.0403406
Topological Polar Surface Area41.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity361
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

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