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LY272015

CAT: 0013-GTR19241650-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241650-03Size:100 mg
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Description
LY272015 is a selective small molecule antagonist of the serotonin 2B receptor (5-HT2BR) . It is a valuable research tool for investigating 5-HT2B receptor function in cardiovascular research and fibrosis studies, applicable in both in vitro and in vivo experimental models.
CAS Number
159730-07-1
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
O (C1=CC=C (C=C1OC) CC2NCCC=3C=4C=C (C=CC4NC32) C) C
Molecular Formula
C21H24N2O2
Molecular Weight
336.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

6W6Aeg3W3E
CAS Number159730-07-1
PubChem CID9929424
IUPAC Name1-[(3,4-dimethoxyphenyl)methyl]-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular FormulaC21H24N2O2
Molecular Weight336.4
XLogP3.8
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity446
SMILES
CC1=CC2=C(C=C1)NC3=C2CCNC3CC4=CC(=C(C=C4)OC)OC
InChI
InChI=1S/C21H24N2O2/c1-13-4-6-17-16(10-13)15-8-9-22-18(21(15)23-17)11-14-5-7-19(24-2)20(12-14)25-3/h4-7,10,12,18,22-23H,8-9,11H2,1-3H3
InChIKey
GDAJGLDMCDMPIR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6W6Aeg3W3E
CAS: 159730-07-1
CID: 9929424
Formula: C21H24N2O2
MW: 336.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight336.4
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass336.183778013
Monoisotopic Mass336.183778013
Topological Polar Surface Area46.3 Ų
Heavy Atom Count25
Formal Charge0
Complexity446
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

Alternative Products

CatalogName
T202880-01LY272015

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