AG00C6FQ

328541-79-3 | (Naphthalen-2-ylamino)-acetic acid (3,5-dibromo-2,4-dihydroxy-benzylidene)-hydrazide

AG00C6FQ

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CAS Number	328541-79-3
Catalog Number	AG00C6FQ(AGN-PC-0R88O3)
Chemical Name	(Naphthalen-2-ylamino)-acetic acid (3,5-dibromo-2,4-dihydroxy-benzylidene)-hydrazide
IUPAC Name	N-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylideneamino]-2-(naphthalen-2-ylamino)acetamide
InChI	InChI=1S/C19H15Br2N3O3/c20-15-8-13(18(26)17(21)19(15)27)9-23-24-16(25)10-22-14-6-5-11-3-1-2-4-12(11)7-14/h1-9,22,26-27H,10H2,(H,24,25)/b23-9+
InChI Key	RMBDLOATEPYBSI-NUGSKGIGSA-N
MDL Number	MFCD01532954
Molecular Formula	C19H15Br2N3O3
Molecular Weight	493.1487
SMILES	O=C(N/N=C/C1=CC(Br)=C(O)C(Br)=C1O)CNC2=CC=C3C=CC=CC3=C2
Synonyms	GlyH-101, N-(2-naphthalenyl)-((3,5-dibromo-2,4-dihydroxyphenyl)methylene)glycine hydrazide, GlyH-101, 328541-79-3, GlyH 101, CHEMBL1221576, CFTR Inhibitor II, GlyH-101, EC-000.1907, N-(2-Naphthalenyl)-((3,5-dibromo-2,4-dihydroxyphenyl)methylene)glycine hydrazide, CFTR Inhibitor II, (Naphthalen-2-ylamino)-acetic acid (3,5-dibromo-2,4,-dihydroxy-benzylidene)-hydrazide, (Naphthalen-2-ylamino)-acetic acid (3,5-dibromo-2,4-dihydroxy-benzylidene)-hydrazide, N-(2-naphthalenyl)-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]glycine hydrazide, N-2-Naphthalenyl-glycine 2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]hydrazide, GlyH - 101, SCHEMBL12648530, EX-A2041, 3698AH, BDBM50324733, AKOS025148694, AKOS026750493, AKOS032947331, CS-2098, BC600597, HY-18336, S8094, J-018908, (Naphthalen-2-ylamino)acetic acid (3,5-dibromo-2,4,-dihydroxybenzylidene)hydrazide, N''-(3,5-dibromo-2,4-dihydroxybenzylidene)-2-(naphthalen-2-ylamino)acetohydrazide, N'-(3,5-dibromo-2,4-dihydroxybenzylidene)-2-(naphthalen-2-ylamino)acetohydrazide, N'-[(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-2-[(naphthalen-2-yl)amino]acetohydrazide, N-2-Naphthalenyl-2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]glycine hydrazide, D0S1FV, -ACETICACID -HYDRAZIDE, AGN-PC-005HH0, C19H15Br2N3O3, CTK8E9894, CID11260414, CID 11260414, B1087, A13723, C548779,

Complexity	536
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	492.946g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	493.155g/mol
Monoisotopic Mass	490.948g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	94A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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