AG00BER6

Name: MMP-8 Inhibitor I
Brand: Angene Chemical
SKU: AG00BER6

236403-25-1 | MMP-8 Inhibitor I

AG00BER6

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CAS Number	236403-25-1
Catalog Number	AG00BER6(AGN-PC-0QZT25)
Chemical Name	MMP-8 Inhibitor I
IUPAC Name	N-hydroxy-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
InChI	InChI=1S/C17H18N2O5S/c1-24-14-6-8-15(9-7-14)25(22,23)19-11-13-5-3-2-4-12(13)10-16(19)17(20)18-21/h2-9,16,21H,10-11H2,1H3,(H,18,20)
InChI Key	PPELJLBDXLMTEW-UHFFFAOYSA-N
MDL Number	MFCD02683950
Molecular Formula	C17H18N2O5S
Molecular Weight	362.4002
SMILES	O=C(NO)[C@@H]1N(S(C2=CC=C(OC)C=C2)(=O)=O)CC3=CC=CC=C3C1
Synonyms	236403-25-1, AC1L1HP7, IN1259, IN1260, N-hydroxy-2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide, 2-(4-Methoxyphenylsulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carbohydroxamic acid, mmp-8 inhibitor i, CID4229, PPELJLBDXLMTEW-UHFFFAOYSA-N,

Complexity	568
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	362.094g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	362.4g/mol
Monoisotopic Mass	362.094g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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