Products for Research Use Only
RegisterLogin

Dalpiciclib isethionate

CAT: 0013-GTR19273263-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19273263-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Dalpiciclib (isethionate) is a CDK4/6 inhibitor that suppresses the kinase activity of CDK4 and CDK6, thereby blocking the cell cycle transition from the G1 phase to the S phase, which inhibits abnormal cell proliferation. Dalpiciclib (isethionate) is utilized in breast cancer research.
CAS Number
1980822-14-7
Smiles
O=C1C (C (=O) C) =C (C=2C=NC (=NC2N1C3CCCC3) NC4=NC=C (C=C4) C5CCNCC5) C.O=S (=O) (O) CCO
Molecular Formula
C27H36N6O6S
Molecular Weight
572.68
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dalpiciclib isethionate

Dalpiciclib Isethionate is the isethionate salt form of dalpiciclib, an orally bioavailable cyclin-dependent kinase (CDK) inhibitor, with potential antineoplastic activity. Upon oral administration, dalpiciclib selectively inhibits cyclin-dependent kinase 4 (CDK4) and 6 (CDK6). This inhibits retinoblastoma (Rb) protein phosphorylation early in the G1 phase, which prevents CDK-mediated G1-S phase transition and leads to cell cycle arrest. This suppresses DNA replication and decreases tumor cell proliferation. CDK4 and 6 are serine/threonine kinases that are upregulated in many tumor cell types and play a key role in the regulation of cell cycle progression.

CAS Number1980822-14-7
PubChem CID132211171
IUPAC Name6-acetyl-8-cyclopentyl-5-methyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one;2-hydroxyethanesulfonic acid
Molecular FormulaC27H36N6O6S
Molecular Weight572.7
Topological Polar Surface Area183
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Heavy Atom Count40
Formal Charge0
Complexity890
SMILES
CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=NC=C(C=C3)C4CCNCC4)C5CCCC5)C(=O)C.C(CS(=O)(=O)O)O
InChI
InChI=1S/C25H30N6O2.C2H6O4S/c1-15-20-14-28-25(29-21-8-7-18(13-27-21)17-9-11-26-12-10-17)30-23(20)31(19-5-3-4-6-19)24(33)22(15)16(2)32;3-1-2-7(4,5)6/h7-8,13-14,17,19,26H,3-6,9-12H2,1-2H3,(H,27,28,29,30);3H,1-2H2,(H,4,5,6)
InChIKey
IWHGWNIWQZCOIR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dalpiciclib isethionate
CAS: 1980822-14-7
CID: 132211171
Formula: C27H36N6O6S
MW: 572.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight572.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass572.24170406
Monoisotopic Mass572.24170406
Topological Polar Surface Area183 Ų
Heavy Atom Count40
Formal Charge0
Complexity890
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19164671-01Dalpiciclib
GTR19185463-01Dalpiciclib hydrochloride
GTR19211272-01Piritrexim isethionate
GTR19197059Mivobulin Isethionate
GTR19191381-01Lamotrigine isethionate
GTR19174505-01Pentamidine isethionate
GTR19172041-01Palbociclib Isethionate
GTR19211302-01Asulacrine isethionate
GTR19193038-01Propamidine isethionate
GTR19163289-01Pentamidine isethionate

Alternative Products

CatalogName
HY-114338BDalpiciclib (isethionate)
T9636-01Dalpiciclib
T63199-01Dalpiciclib hydrochloride
HY-114338A-01Dalpiciclib (hydrochloride)
MBS130303-01Palbociclib-isethionate, PD0332991 isethionate
462087-01PD 0332991 Isethionate Palbociclib Isethionate discontinued
535189Dalpiciclib free base
ICA33744-01Ethyl Isethionate
T34144-01Propamidine isethionate
T36482-01Lamotrigine isethionate

Popular Products