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AZD-7295

CAT: 0931-T30262-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T30262-03Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
929890-64-2
Target
HCV Protease, Others
Related Pathways
Others, Microbiology/Virology, Proteases/Proteasome
Bioactivity
AZD-7295 (A-689) is an NS5A inhibitor that may be used to treat HCV infection.
Smiles
O(C(F)(F)F)C1=C(C=C(NC(=O)C2CC2)C=C1)C3=CC=C(C(NC4=CC=C(CN5CCN(S(CCC)(=O)=O)CC5)C=C4)=O)C=C3
Molecular Formula
C32H35F3N4O5S
Molecular Weight
644.7
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Azd-7295

AZD7295 has been investigated for the treatment of Hepatitis C.

CAS Number929890-64-2
PubChem CID57339445
IUPAC Name4-[5-(cyclopropanecarbonylamino)-2-(trifluoromethoxy)phenyl]-N-[4-[(4-propylsulfonylpiperazin-1-yl)methyl]phenyl]benzamide
Molecular FormulaC32H35F3N4O5S
Molecular Weight644.7
XLogP5
Topological Polar Surface Area116
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Heavy Atom Count45
Formal Charge0
Complexity1090
SMILES
CCCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=C(C=CC(=C4)NC(=O)C5CC5)OC(F)(F)F
InChI
InChI=1S/C32H35F3N4O5S/c1-2-19-45(42,43)39-17-15-38(16-18-39)21-22-3-11-26(12-4-22)36-30(40)24-7-5-23(6-8-24)28-20-27(37-31(41)25-9-10-25)13-14-29(28)44-32(33,34)35/h3-8,11-14,20,25H,2,9-10,15-19,21H2,1H3,(H,36,40)(H,37,41)
InChIKey
MAQDQJWCSSCURR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azd-7295
CAS: 929890-64-2
CID: 57339445
Formula: C32H35F3N4O5S
MW: 644.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight644.7
XLogP35
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Exact Mass644.22802589
Monoisotopic Mass644.22802589
Topological Polar Surface Area116 Ų
Heavy Atom Count45
Formal Charge0
Complexity1090
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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