URMC-099

CAT: 1568-C12623-10mM/1mLSize: 10 mm/ 1 mLDry Ice: YesHazardous: No

1 / 1

CAT#:1568-C12623-10mM/1mLSize:10 mm/ 1 mL

Selected

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

Quick Request Actions

CAS Number

1229582-33-5

Target

LRRK2

Applications

Autophagy

Smiles

CN1CCN (CC1) CC2=CC=C (C=C2) C3=CC4=C (NC=C4C5=CC6=C (C=C5) NC=C6) N=C3

Molecular Formula

C27H27N5

Additionnal Information

URMC-099 is an orally bioavailable, brain penetrant mixed lineage kinase (MLK) inhibitor with IC50 of 19 nM, 42 nM, 14 nM, and 150 nM, for MLK1, MLK2, MLK3, and DLK, respectively, and also inhibits LRRK2 activity with IC50 of 11 nM. URMC-099 also inhibits ABL1 with IC50 of 6.8 nM. URMC-099 induces autophagy.

Storage Conditions

2 years -80 in solvent

Chemical Information

Urmc-099

inhibits mixed lineage kinase 3

CAS Number	1229582-33-5
PubChem CID	54764565
IUPAC Name	3-(1H-indol-5-yl)-5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1H-pyrrolo[2,3-b]pyridine
Molecular Formula	C27H27N5
Molecular Weight	421.5
XLogP	4.3
Topological Polar Surface Area	51
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	32
Formal Charge	0
Complexity	611

SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=C(NC=C4C5=CC6=C(C=C5)NC=C6)N=C3

InChI

InChI=1S/C27H27N5/c1-31-10-12-32(13-11-31)18-19-2-4-20(5-3-19)23-15-24-25(17-30-27(24)29-16-23)21-6-7-26-22(14-21)8-9-28-26/h2-9,14-17,28H,10-13,18H2,1H3,(H,29,30)

InChIKey

QKKIWEILHCXECO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1229582-33-5

CID: 54764565

Formula: C27H27N5

MW: 421.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	421.5
XLogP3	4.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	421.22664588
Monoisotopic Mass	421.22664588
Topological Polar Surface Area	51 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	611
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
C03290-25mg	ML-099
C03290-01	ML-099
C03290-1g	ML-099
C03290-5mg	ML-099
C03290-100mg	ML-099
C14385-5mg	YKL-05-099
C14385-01	YKL-05-099
C14385-25mg	YKL-05-099
C01453	AVE 0991
C01453-5mg	AVE 0991

Alternative Products

Catalog	Name
HY-12599-01	URMC-099
FU170951-01	URMC 099

URMC-099

Chemical Information

Related Products

Alternative Products

Popular Products