Dutogliptin supplier | CasNO.852329-66-9

Name
Dutogliptin
EINECS
CAS No. 852329-66-9
Article Data3
CAS DataBase
Density 1.24±0.1 g/cm3(Predicted)
Solubility
Melting Point
Formula C₁₀H₂₀BN₃O₃
Boiling Point 494.6±55.0 °C(Predicted)
Molecular Weight 241.098
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [1-[2-(Pyrrolidin-3-ylamino)acetyl]pyrrolidin-2-yl]boronic Acid;
PSA 84.83000
LogP -0.98160

Dutogliptin Specification

The Dutogliptin, with the CAS registry number 852329-66-9, is also known as [1-[2-(Pyrrolidin-3-ylamino)acetyl]pyrrolidin-2-yl]boronic acid. This chemical's molecular formula is C₁₀H₂₀BN₃O₃ and molecular weight is 241.0951. What's more, its IUPAC name is called [(2R)-1-[2-[[(3R)-Pyrrolidin-3-yl]amino]acetyl]pyrrolidin-2-yl]boronic acid. The classification code is Treatment of Type 2 Diabetes.

Properties Computed from Structure about Dutogliptin are: (1) H-Bond Donor: 4; (2) H-Bond Acceptor: 5; (3) Rotatable Bond Count: 4; (4) Exact Mass: 241.159772; (5) MonoIsotopic Mass: 241.159772; (6) Topological Polar Surface Area: 84.8; (7) Heavy Atom Count: 17; (8) Formal Charge: 0; (9) Complexity: 278; (10) Isotope Atom Count: 0; (11) Defined Atom StereoCenter Count: 2; (12) Undefined Atom StereoCenter Count: 0; (13) Defined Bond StereoCenter Count: 0; (14) Undefined Bond StereoCenter Count: 0; (15) Covalently-Bonded Unit Count: 1.

You can still convert the following datas into molecular structure:
(1) SMILES: B(C1CCCN1C(=O)CNC2CCNC2)(O)O
(2) 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
(3) InChIKey: DVJAMEIQRSHVKC-BDAKNGLRSA-N

Product Name

Dutogliptin

Dutogliptin Specification

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