Products for Research Use Only
RegisterLogin

CYM 5442 hydrochloride

CAT: 0013-GTR19259680-01Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19259680-01Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
CYM5442 hydrochloride is a potent, highly-selective and orally active sphingosine 1-phosphate (S1P1) receptor agonist with an EC50 of 1.35 nM. CYM5442 hydrochloride is inactive against S1P2, S1P3, S1P4, and S1P5. CYM5442 hydrochloride activates S1P1-dependent p42/p44-MAPK phosphorylation. CYM5442 exerts retinal neuroprotection. CYM5442 hydrochloride can easily penetrate the central nervous system (CNS) .
CAS Number
1783987-80-3
Purity
>98%
Smiles
Cl.O1C (C2C=CC (=C (C=2) OCC) OCC) =NC (C2=CC=CC3=C2CCC3NCCO) =N1
Molecular Formula
C23H28CLN3O4
Molecular Weight
445.939125061035
Notes
For research use only.

Chemical Information

CYM 5442 hydrochloride
CAS Number1783987-80-3
PubChem CID90488865
IUPAC Name2-[[4-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]amino]ethanol;hydrochloride
Molecular FormulaC23H28ClN3O4
Molecular Weight445.9
Topological Polar Surface Area89.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count31
Formal Charge0
Complexity525
SMILES
CCOC1=C(C=C(C=C1)C2=NC(=NO2)C3=C4CCC(C4=CC=C3)NCCO)OCC.Cl
InChI
InChI=1S/C23H27N3O4.ClH/c1-3-28-20-11-8-15(14-21(20)29-4-2)23-25-22(26-30-23)18-7-5-6-17-16(18)9-10-19(17)24-12-13-27;/h5-8,11,14,19,24,27H,3-4,9-10,12-13H2,1-2H3;1H
InChIKey
KMZLVDAVGXYZDA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CYM 5442 hydrochloride
CAS: 1783987-80-3
CID: 90488865
Formula: C23H28ClN3O4
MW: 445.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight445.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass445.1768341
Monoisotopic Mass445.1768341
Topological Polar Surface Area89.6 Ų
Heavy Atom Count31
Formal Charge0
Complexity525
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19213730-01CYM 5442 HCl
GTR19191023-01CYM 50358 hydrochloride
GTR19172630-01CYM 50769
GTR19172629-01CYM-5520
GTR17974749CYM Antibody
GTR19197818-01CYM-5478
GTR19160161-01CYM 5541
GTR19156111-01CYM 5520
GTR19173776-01CYM 50358 hydrochloride (1314212-39-9 free base)
GTR19224924-01NSC10010 hydrochloride

Alternative Products

CatalogName
B7441-10CYM 5442 hydrochloride
B7441-50CYM 5442
407251CYM-5442
MBS384578-01CYM 5442 HCl
A13637-25CYM 5442 HCl 25mg
A13637-50CYM 5442 HCl 50mg
A13637-10CYM 5442 HCl 10mg
TL310291mtRNA polymerase (POLRMT) Human shRNA Plasmid Kit (Locus ID 5442)
SR303632mtRNA polymerase (POLRMT) Human siRNA Oligo Duplex (Locus ID 5442)
TL310291VmtRNA polymerase (POLRMT) Human shRNA Lentiviral Particle (Locus ID 5442)

Popular Products