Products for Research Use Only
RegisterLogin

BMS-986397

CAT: 0013-GTR19236195-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19236195-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
BMS-986397 is a cereblon-based molecular glue degrader targeting casein kinase 1α (CK1α) . It induces rapid apoptosis and cell cycle arrest in TP53 wild-type acute myeloid leukemia (AML) cells, supporting its investigation in preclinical in vitro and in vivo models of AML.
CAS Number
2564486-44-6
Field of Research
Metabolism Research, Pharmacology & Drug Discovery, Stem Cell & Developmental Biology
Smiles
O=C1N (CC=2C1=CC=C (C (N[C@@H] ([C@@] (F) (F) F) C3=C (Cl) C=CC=N3) =O) C2) [C@@H]4C (=O) NC (=O) CC4
Molecular Formula
C21H16ClF3N4O4
Molecular Weight
480.82
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-((R)-1-(3-chloropyridin-2-yl)-2,2,2-trifluoroethyl)-2-((S)-2,6-dioxopiperidin-3-yl)-1-oxoisoindoline-5-carboxamide
CAS Number2564486-44-6
PubChem CID155338753
IUPAC NameN-[(1R)-1-(3-chloro-2-pyridinyl)-2,2,2-trifluoroethyl]-2-[(3S)-2,6-dioxopiperidin-3-yl]-1-oxo-3H-isoindole-5-carboxamide
Molecular FormulaC21H16ClF3N4O4
Molecular Weight480.8
XLogP1.7
Topological Polar Surface Area108
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count33
Formal Charge0
Complexity826
SMILES
C1CC(=O)NC(=O)[C@H]1N2CC3=C(C2=O)C=CC(=C3)C(=O)N[C@H](C4=C(C=CC=N4)Cl)C(F)(F)F
InChI
InChI=1S/C21H16ClF3N4O4/c22-13-2-1-7-26-16(13)17(21(23,24)25)28-18(31)10-3-4-12-11(8-10)9-29(20(12)33)14-5-6-15(30)27-19(14)32/h1-4,7-8,14,17H,5-6,9H2,(H,28,31)(H,27,30,32)/t14-,17+/m0/s1
InChIKey
DGAWFEDONPXNNP-WMLDXEAASA-N
Chemical Structure
2D Structure
2D structure of N-((R)-1-(3-chloropyridin-2-yl)-2,2,2-trifluoroethyl)-2-((S)-2,6-dioxopiperidin-3-yl)-1-oxoisoindoline-5-carboxamide
CAS: 2564486-44-6
CID: 155338753
Formula: C21H16ClF3N4O4
MW: 480.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight480.8
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass480.0812172
Monoisotopic Mass480.0812172
Topological Polar Surface Area108 Ų
Heavy Atom Count33
Formal Charge0
Complexity826
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19258412-01BMS-986497
GTR19162933-01BMS-986195
GTR19231993-01BMS-986365
GTR19210331-01BMS-986318
GTR19212348-01BMS-986339
GTR19210245-01BMS-986313
GTR19197469-01BMS-986094
GTR19234192-01BMS-986308
GTR19155611-01BMS-986242
GTR19160164-01BMS-303141

Alternative Products

CatalogName
E4725-1gBMS-986397
T207587-01(R, R) -BMS-986397
MBS386661-01BMS-806 (BMS 378806)
A11201-2BMS-806 (BMS 378806) 2mg
A11201-1BMS-806 (BMS 378806) 1mg
A11201-25BMS-806 (BMS 378806) 25mg
A11201-500BMS-806 (BMS 378806) 500mg
BA1866-5BMS-986094
BA9174-50BMS-564929
BA5455-5BMS-986278

Popular Products

BMS-986397 | 0013-GTR19236195-01 | Gentaur