Products for Research Use Only
RegisterLogin

Saxagliptin (BMS-477118)

CAT: 0957-S1540-100mgSize: 100 mgDry Ice: YesHazardous: No
Product image 1
1 / 1
CAT#:0957-S1540-100mgSize:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
361442-04-8
Synonyms
Onglyza, BMS-477118
Target
DPP
Applications
Metabolism
Smiles
C1C2CC2N (C1C#N) C (=O) C (C34CC5CC (C3) CC (C5) (C4) O) N
Molecular Formula
C18H25N3O2
Additionnal Information
Saxagliptin (BMS-477118, Onglyza) is a selective and reversible DPP4 inhibitor with IC50 of 26 nM.
Storage Conditions
2 years -80 in solvent

Chemical Information

Saxagliptin

Saxagliptin is a monocarboxylic acid amide obtained by formal condensation of the carboxy group of (2S)-amino(3-hydroxyadamantan-1-yl)acetic acid with the amino group of (1S,3S,5S)-2-azabicyclo[3.1.0]hexane-3-carbonitrile. Used in its monohydrate form for the treatment of Type II diabetes. It has a role as a hypoglycemic agent and an EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor. It is a nitrile, a tertiary alcohol, a monocarboxylic acid amide, an azabicycloalkane and a member of adamantanes.

CAS Number361442-04-8
PubChem CID11243969
IUPAC Name(1S,3S,5S)-2-[(2S)-2-amino-2-(3-hydroxy-1-adamantyl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile
Molecular FormulaC18H25N3O2
Molecular Weight315.4
XLogP0.7
Topological Polar Surface Area90.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity609
SMILES
C1[C@@H]2C[C@@H]2N([C@@H]1C#N)C(=O)[C@H](C34CC5CC(C3)CC(C5)(C4)O)N
InChI
InChI=1S/C18H25N3O2/c19-8-13-2-12-3-14(12)21(13)16(22)15(20)17-4-10-1-11(5-17)7-18(23,6-10)9-17/h10-15,23H,1-7,9,20H2/t10?,11?,12-,13+,14+,15-,17?,18?/m1/s1
InChIKey
QGJUIPDUBHWZPV-SGTAVMJGSA-N
Chemical Structure
2D Structure
2D structure of Saxagliptin
CAS: 361442-04-8
CID: 11243969
Formula: C18H25N3O2
MW: 315.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.4
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass315.19467705
Monoisotopic Mass315.19467705
Topological Polar Surface Area90.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity609
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
E6005-01Saxagliptin hydrochloride
E6005-1gSaxagliptin hydrochloride
E6005-25mgSaxagliptin hydrochloride
S4697-10mgSaxagliptin hydrate
E6005-100mgSaxagliptin hydrochloride
E6005-5mgSaxagliptin hydrochloride
S4697-01Saxagliptin hydrate
S4697-50mgSaxagliptin hydrate
S1012-1gBMS-536924
S1124-50mgBMS-754807

Alternative Products

CatalogName
MBS384390-01Saxagliptin (BMS-477118)
A11109-5Saxagliptin (BMS-477118) 5mg
A11109-200Saxagliptin (BMS-477118) 200mg
A11109-10mM-DSaxagliptin (BMS-477118) 10mM * 1mL in DMSO
RM-S120719-01Saxagliptin Impurity 19 (Bms-554083)
RM-S120717-01Saxagliptin Impurity 17 (Bms-537679)
RM-S120709-01Saxagliptin Impurity 9 (Bms-700047)
RM-S120702-01Saxagliptin Impurity 2 (Bms-794372)
FA29598-01Saxagliptin

Popular Products