AG0095AY

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CAS Number	1046140-32-2
Catalog Number	AG0095AY
Chemical Name	MCHB-1
IUPAC Name	1-(cyclohexylmethyl)-2-[(4-ethoxyphenyl)methyl]-N,N-diethylbenzimidazole-5-carboxamide
InChI	InChI=1S/C28H37N3O2/c1-4-30(5-2)28(32)23-14-17-26-25(19-23)29-27(31(26)20-22-10-8-7-9-11-22)18-21-12-15-24(16-13-21)33-6-3/h12-17,19,22H,4-11,18,20H2,1-3H3
InChI Key	WRVZBXHTUOPQJS-UHFFFAOYSA-N
Molecular Formula	C28H37N3O2
Molecular Weight	447.6123
SMILES	CCOC(C=C1)=CC=C1CC2=NC3=CC(C(N(CC)CC)=O)=CC=C3N2CC4CCCCC4
Synonyms	CHEMBL470965, BDBM50244318, ZINC40893720, 1-(cyclohexylmethyl)-2-(4-ethoxybenzyl)-N,N-diethyl-1h-benzo[d]imidazole-5-carboxamide, 2-(4-ethoxybenzyl)-1-(cyclohexylmethyl)-N,N-diethyl-1H-benzo[d]imidazole-5-carboxamide, 1046140-32-2,

Complexity	596
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	447.289g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	447.623g/mol
Monoisotopic Mass	447.289g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	47.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.2

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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