Products for Research Use Only
RegisterLogin

7-Desmethyl-agomelatine

CAT: 0957-E7212Size: 25 mgDry Ice: YesHazardous: No
Product image 1
1 / 1
CAT#:0957-E7212Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
7-Desmethyl-agomelatine is a metabolite of Agomelatine. Agomelatineis a potent agonist at melatonin receptors (MT1 and MT2), and also is an antagonist of 5-HT2C.
CAS Number
152302-45-9
Storage Conditions
3 years-20°C powder 2 years-80°C in solvent

Chemical Information

N-(2-(7-hydroxy-1-naphthyl)ethyl)acetamide

an agomelatine metabolite

CAS Number152302-45-9
PubChem CID11775984
IUPAC NameN-[2-(7-hydroxynaphthalen-1-yl)ethyl]acetamide
Molecular FormulaC14H15NO2
Molecular Weight229.27
XLogP2.4
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity267
SMILES
CC(=O)NCCC1=CC=CC2=C1C=C(C=C2)O
InChI
InChI=1S/C14H15NO2/c1-10(16)15-8-7-12-4-2-3-11-5-6-13(17)9-14(11)12/h2-6,9,17H,7-8H2,1H3,(H,15,16)
InChIKey
UNTZQBYXDYYXIY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-(7-hydroxy-1-naphthyl)ethyl)acetamide
CAS: 152302-45-9
CID: 11775984
Formula: C14H15NO2
MW: 229.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight229.27
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass229.110278721
Monoisotopic Mass229.110278721
Topological Polar Surface Area49.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity267
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

Related Products

CatalogName
E6011-100mgAgomelatine hydrochloride
E6011-5mgAgomelatine hydrochloride
S1243-01Agomelatine (S20098)
E6011-01Agomelatine hydrochloride
S1243-50mgAgomelatine (S20098)
S1243-10mgAgomelatine (S20098)
E6011-1gAgomelatine hydrochloride
E6011-25mgAgomelatine hydrochloride
S1243-100mgAgomelatine (S20098)
S1243-10mM/1mLAgomelatine (S20098)

Alternative Products

CatalogName
T10193-017-Desmethyl-agomelatine
AR-A01523-017-Desmethyl Agomelatine
RM-A056327-01Agomelatine Impurity G (7-Desmethyl Agomelatine)
HY-133113S-017-Desmethyl-agomelatine-d3
MBS57718347-Desmethyl-agomelatine D3
UFA70551-01Desacetyl-7-desmethyl agomelatine hydrobromide
RGA52700-013-Hydroxy-7-desmethyl agomelatine
RM-A056381-01Desmethyl Agomelatine-D3
259009-01Agomelatine

Popular Products