AG01EOPV

Name: CLK1-IN-1
Brand: Angene Chemical
SKU: AG01EOPV

2123491-32-5 | CLK1-IN-1

AG01EOPV

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CAS Number	2123491-32-5
Catalog Number	AG01EOPV(AGN-PC-3H46H7)
Chemical Name	CLK1-IN-1
IUPAC Name	5-[1-[(1S)-1-(4-fluorophenyl)ethyl]triazolo[4,5-c]quinolin-8-yl]-1,3-benzoxazole
InChI	InChI=1S/C24H16FN5O/c1-14(15-2-6-18(25)7-3-15)30-24-19-10-16(4-8-20(19)26-12-22(24)28-29-30)17-5-9-23-21(11-17)27-13-31-23/h2-14H,1H3/t14-/m0/s1
InChI Key	BHKVSOQUPYXVRZ-AWEZNQCLSA-N
MDL Number	MFCD31692336
Molecular Formula	C24H16FN5O
Molecular Weight	409.4151
SMILES	FC1=CC=C(C=C1)[C@H](C)N1N=NC=2C=NC=3C=CC(=CC3C21)C=2C=CC1=C(N=CO1)C2
Synonyms	CLK1-IN-1, (S)-5-(1-(1-(4-Fluorophenyl)ethyl)-1H-[1,2,3]triazolo[4,5-c]quinolin-8-yl)benzo[d]oxazole, 5-[1-[(1s)-1-(4-Fluorophenyl)ethyl]-[1,2,3]triazolo[4,5-C]quinolin-8-Yl]-1,3-Benzoxazole, CHEMBL4083249, AKOS032963937, HY-103082, CS-0023822, 2123491-32-5, SQZ, N/A,

Complexity	631
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	409.134g/mol
Formal Charge	0
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	409.424g/mol
Monoisotopic Mass	409.134g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	69.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.9

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