Reparixin 10mg

CAT: 0628-A12383-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A12383-10Size:10 mg

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CAS Number

266359-83-5

Chemical Information

Reparixin

Reparixin is a monoterpenoid.

CAS Number	266359-83-5
PubChem CID	9838712
IUPAC Name	(2R)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfonylpropanamide
Molecular Formula	C14H21NO3S
Molecular Weight	283.39
XLogP	2.9
Topological Polar Surface Area	71.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	19
Formal Charge	0
Complexity	389

SMILES

C[C@H](C1=CC=C(C=C1)CC(C)C)C(=O)NS(=O)(=O)C

InChI

InChI=1S/C14H21NO3S/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-19(4,17)18/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1

InChIKey

KQDRVXQXKZXMHP-LLVKDONJSA-N

Chemical Structure

2D Structure

CAS: 266359-83-5

CID: 9838712

Formula: C14H21NO3S

MW: 283.39

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	283.39
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	283.12421471
Monoisotopic Mass	283.12421471
Topological Polar Surface Area	71.6 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	389
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
A15219-10	Reparixin L-lysine salt 10mg
A12383-500	Reparixin 500mg
A12383-100	Reparixin 100mg
A12383-50	Reparixin 50mg
A12383-2	Reparixin 2mg
A12383-25	Reparixin 25mg
A12383-5	Reparixin 5mg
A12383-10mM-D	Reparixin 10mM * 1mL in DMSO
A15219-10mM-D	Reparixin L-lysine salt 10mM * 1mL in DMSO
A15219-100	Reparixin L-lysine salt 100mg