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Dutogliptin

CAT: 0013-GTR19205995-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19205995-03Size:100 mg
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Description
Dutogliptin
CAS Number
852329-66-9
Field of Research
Protein Biochemistry
Smiles
OB (O) [C@@H]1CCCN1C (=O) CN[C@@H]1CCNC1
Molecular Formula
C10H20BN3O3
Molecular Weight
241.10
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dutogliptin

Dutogliptin has been investigated for the treatment of Diabetes Mellitus, Type II.

CAS Number852329-66-9
PubChem CID11253490
IUPAC Name[(2R)-1-[2-[[(3R)-pyrrolidin-3-yl]amino]acetyl]pyrrolidin-2-yl]boronic acid
Molecular FormulaC10H20BN3O3
Molecular Weight241.10
Topological Polar Surface Area84.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count17
Formal Charge0
Complexity278
SMILES
B([C@@H]1CCCN1C(=O)CN[C@@H]2CCNC2)(O)O
InChI
InChI=1S/C10H20BN3O3/c15-10(7-13-8-3-4-12-6-8)14-5-1-2-9(14)11(16)17/h8-9,12-13,16-17H,1-7H2/t8-,9+/m1/s1
InChIKey
DVJAMEIQRSHVKC-BDAKNGLRSA-N
Chemical Structure
2D Structure
2D structure of Dutogliptin
CAS: 852329-66-9
CID: 11253490
Formula: C10H20BN3O3
MW: 241.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight241.10
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass241.1597717
Monoisotopic Mass241.1597717
Topological Polar Surface Area84.8 Ų
Heavy Atom Count17
Formal Charge0
Complexity278
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

Alternative Products

CatalogName
BA7302-1Dutogliptin
HY-10286ADutogliptin (tartrate)
MBS5766552Dutogliptin tartrate
A21573-10Dutogliptin 10mg
A21573-5Dutogliptin 5mg
A21573-50Dutogliptin 50mg
A21573-1Dutogliptin 1mg

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