AG01EOA0

Name: Umbralisib R-enantiomer
Brand: Angene Chemical
SKU: AG01EOA0

1532533-69-9 | Umbralisib R-enantiomer

AG01EOA0

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CAS Number	1532533-69-9
Catalog Number	AG01EOA0(AGN-PC-0WNHFC)
Chemical Name	Umbralisib R-enantiomer
IUPAC Name	2-[(1R)-1-[4-amino-3-(3-fluoro-4-propan-2-yloxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-6-fluoro-3-(3-fluorophenyl)chromen-4-one
InChI	InChI=1S/C31H24F3N5O3/c1-15(2)41-24-9-7-18(12-22(24)34)27-26-30(35)36-14-37-31(26)39(38-27)16(3)29-25(17-5-4-6-19(32)11-17)28(40)21-13-20(33)8-10-23(21)42-29/h4-16H,1-3H3,(H2,35,36,37)/t16-/m1/s1
InChI Key	IUVCFHHAEHNCFT-MRXNPFEDSA-N
MDL Number	MFCD30534428
Molecular Formula	C31H24F3N5O3
Molecular Weight	571.5492
SMILES	C1([C@@H](C)N2C3C(C(C4=CC=C(OC(C)C)C(F)=C4)=N2)=C(N)N=CN=3)OC2=CC=C(F)C=C2C(=O)C=1C1=CC=CC(F)=C1
Synonyms	Umbralisib R-enantiomer, 1532533-69-9, TGR-1202 R-enantiomer, TGR-1202 (enantiomer), CHEMBL4115084, SCHEMBL15557158, BDBM184557, BCP24683, HY-12279F, AKOS032945104, CS-6117, US9150579, B2,

Complexity	1020
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	571.183g/mol
Formal Charge	0
Heavy Atom Count	42
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	571.56g/mol
Monoisotopic Mass	571.183g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	105A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.8

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