ChemR23-IN-2

CAT: 0931-T63520-01Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0931-T63520-01Size:25 mg

Selected

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

Quick Request Actions

CAS Number

2465086-50-2

Target

Others, Chemerin Receptor

Related Pathways

Others, GPCR/G Protein

Bioactivity

ChemR23-IN-2 is a potent, orally active inhibitor of ChemR23 (IC50: 3.2 nM) .

Smiles

CC1=CC(=C(C=C1)C2=NOC(=O)N2)C3=CC=C([C@H](N(CC4CC4)C5=NC=6C(O5)=CC=CC6C(O)=O)C)C=C3

Molecular Formula

C29H26N4O5

Molecular Weight

510.54

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

ChemR23-IN-2

CAS Number	2465086-50-2
PubChem CID	162641724
IUPAC Name	2-[cyclopropylmethyl-[(1R)-1-[4-[5-methyl-2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]ethyl]amino]-1,3-benzoxazole-4-carboxylic acid
Molecular Formula	C29H26N4O5
Molecular Weight	510.5
XLogP	5.9
Topological Polar Surface Area	117
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	8
Heavy Atom Count	38
Formal Charge	0
Complexity	917

SMILES

CC1=CC(=C(C=C1)C2=NOC(=O)N2)C3=CC=C(C=C3)[C@@H](C)N(CC4CC4)C5=NC6=C(C=CC=C6O5)C(=O)O

InChI

InChI=1S/C29H26N4O5/c1-16-6-13-21(26-31-29(36)38-32-26)23(14-16)20-11-9-19(10-12-20)17(2)33(15-18-7-8-18)28-30-25-22(27(34)35)4-3-5-24(25)37-28/h3-6,9-14,17-18H,7-8,15H2,1-2H3,(H,34,35)(H,31,32,36)/t17-/m1/s1

InChIKey

FWMIYMSIZWIVNI-QGZVFWFLSA-N

Chemical Structure

2D Structure

CAS: 2465086-50-2

CID: 162641724

Formula: C29H26N4O5

MW: 510.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	510.5
XLogP3	5.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	8
Exact Mass	510.19031994
Monoisotopic Mass	510.19031994
Topological Polar Surface Area	117 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	917
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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
T72933-01	ChemR23-IN-3
T63347-01	ChemR23-IN-1
T63195-01	ChemR23-IN-4
T208185-01	ChemR23 ligand-1
TN9304-01	2,2,2-Trifluoroacetamide
T37709	2,2,2-Trichloroethanol
T125691-01	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl bromide
T9894-01	2-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl methanesulfonate
TN9630-01	2,2':6',2''-Terpyridine
T5650-01	2,2':5',2''-Terthiophene

Alternative Products

Catalog	Name
GTR19185127-01	ChemR23-IN-2
310668-01	ChemR23
YP-W10999-01	Human ChemR23 (ChemR23) ELISA Kit
HY-147642	ChemR23-IN-4
387470	ChemR23 discontinued
GTR19212524-01	ChemR23-IN-3
BA5267-10	ChemR23-IN-1
C12193-01	ChemR23 Antibody
sc-33726	ChemR23 (BZ332)
MBS8521878-01	ChemR23 Polyclonal Antibody

ChemR23-IN-2

Chemical Information

Related Products

Alternative Products

Popular Products