AG01E5QD

Name: ML-261
Brand: Angene Chemical
SKU: AG01E5QD

902523-58-4 | ML-261

AG01E5QD

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CAS Number	902523-58-4
Catalog Number	AG01E5QD(AGN-PC-0WP02Q)
Chemical Name	ML-261
IUPAC Name	2-chloro-N-[2-(3,4-diethoxyphenyl)ethyl]-4-methylthieno[3,2-b]pyrrole-5-carboxamide
InChI	InChI=1S/C20H23ClN2O3S/c1-4-25-16-7-6-13(10-17(16)26-5-2)8-9-22-20(24)15-11-18-14(23(15)3)12-19(21)27-18/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,22,24)
InChI Key	DGNXYXASQJMULD-UHFFFAOYSA-N
MDL Number	MFCD14786336
Molecular Formula	C20H23ClN2O3S
Molecular Weight	406.9262
SMILES	CCOC1=C(OCC)C=C(CCNC(C2=CC(SC(Cl)=C3)=C3N2C)=O)C=C1
Synonyms	ML261, 902523-58-4, ML-261, SMR000130881, MLS000520470, MLS003874039, MLS003880357, CHEMBL1303036, AOB1164, HMS2358F11, ZINC5036574, AKOS001504202, MCULE-1739160044, NCGC00386867-04, AS-16623, MLS-0079804.0001, MLS-0079804.0002, 2-chloro-N-[2-(3,4-diethoxyphenyl)ethyl]-4-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide, DGNXYXASQJMULD-UHFFFAOYSA-N, CID9550710,

Complexity	498
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	406.112g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	406.925g/mol
Monoisotopic Mass	406.112g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	80.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5

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