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AZD7594

CAT: 0926-WXB50960-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0926-WXB50960-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1196509-60-0
MDL Number
MFCD31540640
Smiles
C[C@@H] ([C@@H] (C1=CC2=C (C=C1) OCCO2) OC3=CC4=C (C=C3) N (N=C4) C5=CC=CC (=C5) C (=O) NC6CCOC6) NC (=O) C (C) (F) F
Molecular Formula
C32H32F2N4O6
Molecular Weight
606.62 g/mol
Controlled
No

Chemical Information

Velsecorat

Velsecorat is under investigation in clinical trial NCT02479412 (A Multiple Dosing (14 Days) Study to Assess Efficacy and Safety of Three Dose Levels of AZD7594, Given Once Daily by Inhalation, in Patients With Mild to Moderate Asthma).

CAS Number1196509-60-0
PubChem CID139593415
IUPAC Name3-[5-[(1S,2R)-2-(2,2-difluoropropanoylamino)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)propoxy]indazol-1-yl]-N-[(3R)-oxolan-3-yl]benzamide
Molecular FormulaC32H32F2N4O6
Molecular Weight606.6
XLogP4.6
Topological Polar Surface Area113
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Heavy Atom Count44
Formal Charge0
Complexity1010
SMILES
C[C@H]([C@H](C1=CC2=C(C=C1)OCCO2)OC3=CC4=C(C=C3)N(N=C4)C5=CC=CC(=C5)C(=O)N[C@@H]6CCOC6)NC(=O)C(C)(F)F
InChI
InChI=1S/C32H32F2N4O6/c1-19(36-31(40)32(2,33)34)29(20-6-9-27-28(16-20)43-13-12-42-27)44-25-7-8-26-22(15-25)17-35-38(26)24-5-3-4-21(14-24)30(39)37-23-10-11-41-18-23/h3-9,14-17,19,23,29H,10-13,18H2,1-2H3,(H,36,40)(H,37,39)/t19-,23-,29-/m1/s1
InChIKey
ZZWJKLGCDHYVMB-XGBAOLAVSA-N
Chemical Structure
2D Structure
2D structure of Velsecorat
CAS: 1196509-60-0
CID: 139593415
Formula: C32H32F2N4O6
MW: 606.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight606.6
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass606.22899108
Monoisotopic Mass606.22899108
Topological Polar Surface Area113 Ų
Heavy Atom Count44
Formal Charge0
Complexity1010
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TZA91330-01AZD5904
RRB85285-01AZD7507
VTB00478-01AZD7624

Alternative Products

CatalogName
MBS3844318-01AZD7594
A19866-5Velsecorat (AZD7594) 5mg
A19866-10Velsecorat (AZD7594) 10mg
A19866-2Velsecorat (AZD7594) 2mg
A19866-1Velsecorat (AZD7594) 1mg
A19866-100Velsecorat (AZD7594) 100mg
A19866-50Velsecorat (AZD7594) 50mg
A19866-25Velsecorat (AZD7594) 25mg
A19866-10mM-DVelsecorat (AZD7594) 10mM * 1mL in DMSO

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