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Dibenamine

CAT: 0013-GTR19210759-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210759-01Size:25 mg
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Description
Dibenamine is an alpha-adrenergic receptor antagonist that inhibits both basal and histamine-induced gastric acid secretion. It is used in pharmacological research to study autonomic nervous system functions and gastric physiology in both in vitro and in vivo experimental models.
CAS Number
51-50-3
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Smiles
N (CC1=CC=CC=C1) (CC2=CC=CC=C2) CCCl
Molecular Formula
C16H18ClN
Molecular Weight
259.77
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(2-Chloroethyl)dibenzylamine
CAS Number51-50-3
PubChem CID5820
IUPAC NameN,N-dibenzyl-2-chloroethanamine
Molecular FormulaC16H18ClN
Molecular Weight259.77
XLogP3.8
Topological Polar Surface Area3.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count6
Heavy Atom Count18
Formal Charge0
Complexity187
SMILES
C1=CC=C(C=C1)CN(CCCl)CC2=CC=CC=C2
InChI
InChI=1S/C16H18ClN/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-10H,11-14H2
InChIKey
GSLWSSUWNCJILM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-Chloroethyl)dibenzylamine
CAS: 51-50-3
CID: 5820
Formula: C16H18ClN
MW: 259.77
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight259.77
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count6
Exact Mass259.1127773
Monoisotopic Mass259.1127773
Topological Polar Surface Area3.2 Ų
Heavy Atom Count18
Formal Charge0
Complexity187
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes