Products for Research Use Only

Alprenolol tartrate

CAT: 0013-GTR19210133-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210133-01Size:25 mg
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Description
Alprenolol tartrate acts as a 5-HT1A receptor antagonist. This small molecule is utilized in neuroscience research for in vitro receptor binding studies and in vivo experiments investigating serotonin receptor function in behavioral and cardiovascular models.
CAS Number
21378-88-1
Field of Research
Pharmacology & Drug Discovery
Smiles
O[C@H] ([C@@H] (O) C (O) =O) C (O) =O.CC (C) NCC (O) COc1ccccc1CC=C
Molecular Formula
C19H29NO8
Molecular Weight
399.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Alprenolol tartrate
CAS Number21378-88-1
PubChem CID91810505
IUPAC Name(2R,3R)-2,3-dihydroxybutanedioic acid;1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol
Molecular FormulaC19H29NO8
Molecular Weight399.4
Topological Polar Surface Area157
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count11
Heavy Atom Count28
Formal Charge0
Complexity364
SMILES
CC(C)NCC(COC1=CC=CC=C1CC=C)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
InChI
InChI=1S/C15H23NO2.C4H6O6/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3;5-1(3(7)8)2(6)4(9)10/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
InChIKey
MADUQKMQKQDWJH-LREBCSMRSA-N
Chemical Structure
2D Structure
2D structure of Alprenolol tartrate
CAS: 21378-88-1
CID: 91810505
Formula: C19H29NO8
MW: 399.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight399.4
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count11
Exact Mass399.18931688
Monoisotopic Mass399.18931688
Topological Polar Surface Area157 Ų
Heavy Atom Count28
Formal Charge0
Complexity364
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes