AG01FNFN

Name: BI 3812
Brand: Angene Chemical
SKU: AG01FNFN

2166387-64-8 | BI 3812

AG01FNFN

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CAS Number	2166387-64-8
Catalog Number	AG01FNFN(AGN-PC-3H4BEN)
Chemical Name	BI 3812
IUPAC Name	1-[5-chloro-4-[[8-methoxy-1-methyl-3-[2-(methylamino)-2-oxoethoxy]-2-oxoquinolin-6-yl]amino]pyrimidin-2-yl]-N,N-dimethylpiperidine-4-carboxamide
InChI	InChI=1S/C26H32ClN7O5/c1-28-21(35)14-39-20-11-16-10-17(12-19(38-5)22(16)33(4)25(20)37)30-23-18(27)13-29-26(31-23)34-8-6-15(7-9-34)24(36)32(2)3/h10-13,15H,6-9,14H2,1-5H3,(H,28,35)(H,29,30,31)
InChI Key	XCGYXEVLQIIEJH-UHFFFAOYSA-N
MDL Number	MFCD31657385
Molecular Formula	C26H32ClN7O5
Molecular Weight	558.0292
SMILES	O=C1C(OCC(=O)NC)=CC=2C=C(C=C(OC)C2N1C)NC3=NC(=NC=C3Cl)N4CCC(C(=O)N(C)C)CC4
Synonyms	BI-3812, 2166387-64-8, SCHEMBL20284237, HY-111381, CS-0040299,

Complexity	928
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	557.215g/mol
Formal Charge	0
Heavy Atom Count	39
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	558.036g/mol
Monoisotopic Mass	557.215g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	129A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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