Lck Inhibitor

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CAS Number

213743-31-8

Chemical Information

7-Cyclopentyl-5-(4-phenoxy)phenyl-7H-pyrrolo(2,3-d)pyrimidin-4-ylamine

RK-24466 is a member of the class of pyrrolopyrimidines that is 7H-pyrrolo[2,3-d]pyrimidine substituted by amino, 4-phenoxyphenyl, and cyclopentyl groups at positions 4, 5 and 7, respectively. It is a potent inhibitor of Lck that inhibits Lck (64-509) and LckCD isoforms (IC50 of less than 1 and 2 nM, respectively). It has a role as a geroprotector and an EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor. It is a member of cyclopentanes, an aromatic amine, an aromatic ether, a pyrrolopyrimidine and a primary amino compound.

CAS Number	213743-31-8
PubChem CID	6603792
IUPAC Name	7-cyclopentyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine
Molecular Formula	C23H22N4O
Molecular Weight	370.4
XLogP	4.6
Topological Polar Surface Area	66
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	28
Formal Charge	0
Complexity	497

SMILES

C1CCC(C1)N2C=C(C3=C(N=CN=C32)N)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C23H22N4O/c24-22-21-20(14-27(17-6-4-5-7-17)23(21)26-15-25-22)16-10-12-19(13-11-16)28-18-8-2-1-3-9-18/h1-3,8-15,17H,4-7H2,(H2,24,25,26)

InChIKey

FMETVQKSDIOGPX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 213743-31-8

CID: 6603792

Formula: C23H22N4O

MW: 370.4

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	370.4
XLogP3	4.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	370.17936134
Monoisotopic Mass	370.17936134
Topological Polar Surface Area	66 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	497
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

Related Products

Catalog	Name
sc-433	Lck (3A5)
sc-135971	Lck (28)
sc-433 HRP	Lck (3A5) HRP
sc-166628	Lck (D-8)
sc-29392	Lck siRNA (h)
sc-433 PE	Lck (3A5) PE
sc-433 AC	Lck (3A5) AC
sc-35799-PR	Lck (m) -PR
sc-433 FITC	Lck (3A5) FITC
sc-166627	Lck (B-10)

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Lck Inhibitor

Chemical Information

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