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R1487

CAT: 0931-T7667-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T7667-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
449811-92-1
Target
P38 MAPK
Related Pathways
MAPK
Purity
0.9977
Bioactivity
R1487 is an orally bioavailable and highly selective p38α mitogen-activated protein kinase inhibitor.
Smiles
Cn1c2nc(NC3CCOCC3)ncc2cc(Oc2ccc(F)cc2F)c1=O
Molecular Formula
C19H18F2N4O3
Molecular Weight
388.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

R-1487
CAS Number449811-92-1
PubChem CID11406590
IUPAC Name6-(2,4-difluorophenoxy)-8-methyl-2-(oxan-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
Molecular FormulaC19H18F2N4O3
Molecular Weight388.4
XLogP2.8
Topological Polar Surface Area76.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity602
SMILES
CN1C2=NC(=NC=C2C=C(C1=O)OC3=C(C=C(C=C3)F)F)NC4CCOCC4
InChI
InChI=1S/C19H18F2N4O3/c1-25-17-11(10-22-19(24-17)23-13-4-6-27-7-5-13)8-16(18(25)26)28-15-3-2-12(20)9-14(15)21/h2-3,8-10,13H,4-7H2,1H3,(H,22,23,24)
InChIKey
KKKRKRMVJRHDMG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of R-1487
CAS: 449811-92-1
CID: 11406590
Formula: C19H18F2N4O3
MW: 388.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight388.4
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass388.13469677
Monoisotopic Mass388.13469677
Topological Polar Surface Area76.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity602
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