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AZD8186

CAT: 1568-C12880-25mgSize: 25 mgDry Ice: YesHazardous: No
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CAT#:1568-C12880-25mgSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1627494-13-6
Target
PI3K
Applications
PI3K/Akt/mTOR
Smiles
CC (C1=CC (=CC2=C1OC (=CC2=O) N3CCOCC3) C (=O) N (C) C) NC4=CC (=CC (=C4) F) F
Molecular Formula
C24H25F2N3O4
Additionnal Information
AZD8186 is a potent and selective inhibitor of PI3Kβ and PI3Kδ with IC50 of 4 nM and 12 nM, respectively. Phase 1.
Storage Conditions
2 years -80 in solvent

Chemical Information

Azd-8186

AZD-8186 is under investigation in clinical trial NCT03218826 (PI3Kbeta Inhibitor AZD8186 and Docetaxel in Treating Patients Advanced Solid Tumors With PTEN or PIK3CB Mutations That Are Metastatic or Cannot Be Removed by Surgery).

CAS Number1627494-13-6
PubChem CID52913813
IUPAC Name8-[(1R)-1-(3,5-difluoroanilino)ethyl]-N,N-dimethyl-2-morpholin-4-yl-4-oxochromene-6-carboxamide
Molecular FormulaC24H25F2N3O4
Molecular Weight457.5
XLogP3
Topological Polar Surface Area71.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity748
SMILES
C[C@H](C1=CC(=CC2=C1OC(=CC2=O)N3CCOCC3)C(=O)N(C)C)NC4=CC(=CC(=C4)F)F
InChI
InChI=1S/C24H25F2N3O4/c1-14(27-18-11-16(25)10-17(26)12-18)19-8-15(24(31)28(2)3)9-20-21(30)13-22(33-23(19)20)29-4-6-32-7-5-29/h8-14,27H,4-7H2,1-3H3/t14-/m1/s1
InChIKey
LMJFJIDLEAWOQJ-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of Azd-8186
CAS: 1627494-13-6
CID: 52913813
Formula: C24H25F2N3O4
MW: 457.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight457.5
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass457.18131261
Monoisotopic Mass457.18131261
Topological Polar Surface Area71.1 Ų
Heavy Atom Count33
Formal Charge0
Complexity748
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

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