AG00C6K2

Name: Y16
Brand: Angene Chemical
SKU: AG00C6K2

429653-73-6 | Y16

AG00C6K2

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CAS Number	429653-73-6
Catalog Number	AG00C6K2(AGN-PC-0WGDF5)
Chemical Name	Y16
IUPAC Name	4-[[3-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione
InChI	InChI=1S/C24H20N2O3/c1-17-7-5-9-19(13-17)16-29-21-12-6-8-18(14-21)15-22-23(27)25-26(24(22)28)20-10-3-2-4-11-20/h2-15H,16H2,1H3,(H,25,27)
InChI Key	ITMLWGWTDWJSRZ-UHFFFAOYSA-N
MDL Number	MFCD03083787
Molecular Formula	C24H20N2O3
Molecular Weight	384.4272
SMILES	O=C(N1)/C(C(N1C2=CC=CC=C2)=O)=CC3=CC(OCC4=CC(C)=CC=C4)=CC=C3
Synonyms	429653-73-6, Y16, 4-[[3-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione, AC1MELIY, RhoA-IN-Y16, BCP25513, AKOS032960437, MCULE-4641607457, ZINC00640772, CID2905264,

Complexity	626
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	384.147g/mol
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	384.435g/mol
Monoisotopic Mass	384.147g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	4.7

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