AG01EB16

Name: MKC3946
Brand: Angene Chemical
SKU: AG01EB16

1093119-54-0 | MKC3946

AG01EB16

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CAS Number	1093119-54-0
Catalog Number	AG01EB16
Chemical Name	MKC3946
IUPAC Name	2-hydroxy-6-[5-(4-methylpiperazine-1-carbonyl)thiophen-2-yl]naphthalene-1-carbaldehyde
InChI	InChI=1S/C21H20N2O3S/c1-22-8-10-23(11-9-22)21(26)20-7-6-19(27-20)15-2-4-16-14(12-15)3-5-18(25)17(16)13-24/h2-7,12-13,25H,8-11H2,1H3
InChI Key	IVQVBMWPWPTSNO-UHFFFAOYSA-N
MDL Number	MFCD30496700
Molecular Formula	C21H20N2O3S
Molecular Weight	380.4601
SMILES	O=CC1=C2C=CC(C3=CC=C(C(N4CCN(C)CC4)=O)S3)=CC2=CC=C1O
Synonyms	MKC3946, 1093119-54-0, US8614253, 33-3, CHEMBL3665060, SCHEMBL12767181, BDBM111376, BCP20799, MKC-3946, ZINC43202385, CS-6002, AK683991, HY-19710, US8614253, 32-12, 2-hydroxy-6-[5-(4-methyl-piperazine-1-carbonyl)-thiophen-2-yl]-naphthalene-1-carbaldehyde, 2-hydroxy-6-[5-(4-methylpiperazine-1-carbonyl)thiophen-2-yl]naphthalene-1-carbaldehyde,

Complexity	552
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	380.119g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	380.462g/mol
Monoisotopic Mass	380.119g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	89.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

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