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Ambucetamide

CAT: 0013-GTR19198260-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198260-01Size:25 mg
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Description
Ambucetamide is an antispasmodic agent that suppresses spontaneous, rhythmic contractions of the uterine muscle (myometrium) . It is used in pharmacological research to study smooth muscle physiology and to investigate uterine spasm mechanisms in both in vitro tissue models and in vivo experimental settings.
CAS Number
519-88-0
Field of Research
Pharmacology & Drug Discovery
Smiles
C (N (CCCC) CCCC) (C (N) =O) C1=CC=C (OC) C=C1
Molecular Formula
C17H28N2O2
Molecular Weight
292.42
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ambucetamide

Ambucetamide is an amino acid amide.

CAS Number519-88-0
PubChem CID10616
IUPAC Name2-(dibutylamino)-2-(4-methoxyphenyl)acetamide
Molecular FormulaC17H28N2O2
Molecular Weight292.4
XLogP3.4
Topological Polar Surface Area55.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Heavy Atom Count21
Formal Charge0
Complexity281
SMILES
CCCCN(CCCC)C(C1=CC=C(C=C1)OC)C(=O)N
InChI
InChI=1S/C17H28N2O2/c1-4-6-12-19(13-7-5-2)16(17(18)20)14-8-10-15(21-3)11-9-14/h8-11,16H,4-7,12-13H2,1-3H3,(H2,18,20)
InChIKey
WUSAVCGXMSWMQM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ambucetamide
CAS: 519-88-0
CID: 10616
Formula: C17H28N2O2
MW: 292.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight292.4
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count10
Exact Mass292.215078140
Monoisotopic Mass292.215078140
Topological Polar Surface Area55.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity281
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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