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AD-2646

CAT: 0013-GTR19200597-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200597-01Size:25 mg
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Description
AD-2646 is a research compound exhibiting antidepressant properties. It also functions as an inhibitor of gastric acid secretion induced by 2-deoxy-D-glucose (2-DG) . This dual activity makes it a useful pharmacological tool for investigating neuropsychiatric and gastrointestinal disorders in both in vitro and in vivo experimental models.
CAS Number
366487-89-0
Field of Research
Cell Biology, Epigenetics & Chromatin, Molecular Biology, Protein Biochemistry
Smiles
CCCCCCCCCCCCCCN[C@H] (CO) [C@@H] (C1=CC=C (C=C1) [N+] ([O-]) =O) O
Molecular Formula
C23H40N2O4
Molecular Weight
408.57
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,3-Propanediol, 1-(4-nitrophenyl)-2-(tetradecylamino)-, (1R,2R)-
CAS Number366487-89-0
PubChem CID9801592
IUPAC Name(1R,2R)-1-(4-nitrophenyl)-2-(tetradecylamino)propane-1,3-diol
Molecular FormulaC23H40N2O4
Molecular Weight408.6
XLogP6.5
Topological Polar Surface Area98.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count17
Heavy Atom Count29
Formal Charge0
Complexity395
SMILES
CCCCCCCCCCCCCCN[C@H](CO)[C@@H](C1=CC=C(C=C1)[N+](=O)[O-])O
InChI
InChI=1S/C23H40N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-24-22(19-26)23(27)20-14-16-21(17-15-20)25(28)29/h14-17,22-24,26-27H,2-13,18-19H2,1H3/t22-,23-/m1/s1
InChIKey
SJHLKUDCBZZUEE-DHIUTWEWSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Propanediol, 1-(4-nitrophenyl)-2-(tetradecylamino)-, (1R,2R)-
CAS: 366487-89-0
CID: 9801592
Formula: C23H40N2O4
MW: 408.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight408.6
XLogP36.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count17
Exact Mass408.29880776
Monoisotopic Mass408.29880776
Topological Polar Surface Area98.3 Ų
Heavy Atom Count29
Formal Charge0
Complexity395
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

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