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Navarixin (SCH-527123)

CAT: 0957-S8506-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0957-S8506-100mgSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
473727-83-2
Synonyms
MK-7123, PS-291822
Target
CXCR
Applications
GPCR & G Protein
Smiles
CCC (C1=CC=C (O1) C) NC2=C (C (=O) C2=O) NC3=CC=CC (=C3O) C (=O) N (C) C
Molecular Formula
C21H23N3O5
Additionnal Information
Navarixin (SCH-527123, MK-7123, PS-291822) is a potent, orally bioavailable CXCR2/CXCR1 antagonist with IC50 values of 2.6 nM and 36 nM, respectively.
Storage Conditions
3 years -20°C powder

Chemical Information

Navarixin Anhydrous

Navarixin has been investigated for the treatment of Asthma.

CAS Number473727-83-2
PubChem CID9865554
IUPAC Name2-hydroxy-N,N-dimethyl-3-[[2-[[(1R)-1-(5-methylfuran-2-yl)propyl]amino]-3,4-dioxocyclobuten-1-yl]amino]benzamide
Molecular FormulaC21H23N3O5
Molecular Weight397.4
XLogP3.1
Topological Polar Surface Area112
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity704
SMILES
CC[C@H](C1=CC=C(O1)C)NC2=C(C(=O)C2=O)NC3=CC=CC(=C3O)C(=O)N(C)C
InChI
InChI=1S/C21H23N3O5/c1-5-13(15-10-9-11(2)29-15)22-16-17(20(27)19(16)26)23-14-8-6-7-12(18(14)25)21(28)24(3)4/h6-10,13,22-23,25H,5H2,1-4H3/t13-/m1/s1
InChIKey
RXIUEIPPLAFSDF-CYBMUJFWSA-N
Chemical Structure
2D Structure
2D structure of Navarixin Anhydrous
CAS: 473727-83-2
CID: 9865554
Formula: C21H23N3O5
MW: 397.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight397.4
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass397.16377084
Monoisotopic Mass397.16377084
Topological Polar Surface Area112 Ų
Heavy Atom Count29
Formal Charge0
Complexity704
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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Alternative Products

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MBS386848-01SCH-527123 (Navarixin)
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A11555-1SCH-527123 (Navarixin) 1mg
A11555-500SCH-527123 (Navarixin) 500mg
A11555-10mM-DSCH-527123 (Navarixin) 10mM * 1mL in DMSO
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