AG00ADWJ

Name: AgoMelatine DiMer Urea
Brand: Angene Chemical
SKU: AG00ADWJ

185421-27-6 | AgoMelatine DiMer Urea

AG00ADWJ

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CAS Number	185421-27-6
Catalog Number	AG00ADWJ(AGN-PC-0O5EML)
Chemical Name	AgoMelatine DiMer Urea
IUPAC Name	1,3-bis[2-(7-methoxynaphthalen-1-yl)ethyl]urea
InChI	InChI=1S/C27H28N2O3/c1-31-23-11-9-19-5-3-7-21(25(19)17-23)13-15-28-27(30)29-16-14-22-8-4-6-20-10-12-24(32-2)18-26(20)22/h3-12,17-18H,13-16H2,1-2H3,(H2,28,29,30)
InChI Key	XXLOKCBHVVICPZ-UHFFFAOYSA-N
MDL Number	MFCD27996050
Molecular Formula	C27H28N2O3
Molecular Weight	428.5228
SMILES	COC1=CC2=C(C=CC=C2CCNC(=O)NCCC3=CC=CC4=C3C=C(C=C4)OC)C=C1
Synonyms	Agomelatine Dimer Urea, 185421-27-6, Agomelatine Impurity II, 1,3-Bis[2-(7-methoxynaphthalen-1-yl)ethyl]urea,

Complexity	537
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	428.21g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	428.532g/mol
Monoisotopic Mass	428.21g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	59.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.7

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited