JAK3-IN-2 10mg

CAT: 0628-A18323-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A18323-10Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1443235-95-7

Chemical Information

Jak3-IN-6

CAS Number	1443235-95-7
PubChem CID	89629876
IUPAC Name	ethyl 4-[3-(2-methylprop-2-enoylamino)phenyl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
Molecular Formula	C19H18N4O3
Molecular Weight	350.4
XLogP	2.7
Topological Polar Surface Area	97
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	26
Formal Charge	0
Complexity	553

SMILES

CCOC(=O)C1=CNC2=NC=NC(=C12)C3=CC(=CC=C3)NC(=O)C(=C)C

InChI

InChI=1S/C19H18N4O3/c1-4-26-19(25)14-9-20-17-15(14)16(21-10-22-17)12-6-5-7-13(8-12)23-18(24)11(2)3/h5-10H,2,4H2,1,3H3,(H,23,24)(H,20,21,22)

InChIKey

NJPHKVOXHRAPGJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1443235-95-7

CID: 89629876

Formula: C19H18N4O3

MW: 350.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	350.4
XLogP3	2.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	350.13789045
Monoisotopic Mass	350.13789045
Topological Polar Surface Area	97 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	553
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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