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RO9021

CAT: 0013-GTR19156117-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156117-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
RO9021 is an orally bioavailable, novel ATP-competitive SYK inhibitor (average IC50: 5.6 nM) .
CAS Number
1446790-62-0
Purity
>98% (HPLC)
Solubility
DMSO:3 mg/mL (8.44 mM; Need ultrasonic)
Smiles
Cc (cc1) c (C) nc1Nc1cc (N[C@H] (CCCC2) [C@H]2N) nnc1C (N) =O
Molecular Formula
C18H25N7O
Molecular Weight
355.44
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

6-{[(1r,2s)-2-Aminocyclohexyl]amino}-4-[(5,6-Dimethylpyridin-2-Yl)amino]pyridazine-3-Carboxamide
CAS Number1446790-62-0
PubChem CID71626896
IUPAC Name6-[[(1R,2S)-2-aminocyclohexyl]amino]-4-[(5,6-dimethyl-2-pyridinyl)amino]pyridazine-3-carboxamide
Molecular FormulaC18H25N7O
Molecular Weight355.4
XLogP1.9
Topological Polar Surface Area132
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity476
SMILES
CC1=C(N=C(C=C1)NC2=CC(=NN=C2C(=O)N)N[C@@H]3CCCC[C@@H]3N)C
InChI
InChI=1S/C18H25N7O/c1-10-7-8-15(21-11(10)2)23-14-9-16(24-25-17(14)18(20)26)22-13-6-4-3-5-12(13)19/h7-9,12-13H,3-6,19H2,1-2H3,(H2,20,26)(H2,21,22,23,24)/t12-,13+/m0/s1
InChIKey
XJZVCDVZCRLIKN-QWHCGFSZSA-N
Chemical Structure
2D Structure
2D structure of 6-{[(1r,2s)-2-Aminocyclohexyl]amino}-4-[(5,6-Dimethylpyridin-2-Yl)amino]pyridazine-3-Carboxamide
CAS: 1446790-62-0
CID: 71626896
Formula: C18H25N7O
MW: 355.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight355.4
XLogP31.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass355.21205845
Monoisotopic Mass355.21205845
Topological Polar Surface Area132 Ų
Heavy Atom Count26
Formal Charge0
Complexity476
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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B6158-50RO9021
A16686-5RO9021 5mg
A16686-50RO9021 50mg
A16686-100RO9021 100mg
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A16686-25RO9021 25mg
A16686-10RO9021 10mg

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