AG006Z3B

211555-08-7 | 3-[(6,7-Dimethoxyquinazolin-4-yl)amino]phenol

AG006Z3B

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CAS Number	211555-08-7
Catalog Number	AG006Z3B(AGN-PC-0JK7C2)
Chemical Name	3-[(6,7-Dimethoxyquinazolin-4-yl)amino]phenol
IUPAC Name	3-[(6,7-dimethoxyquinazolin-4-yl)amino]phenol
InChI	InChI=1S/C16H15N3O3/c1-21-14-7-12-13(8-15(14)22-2)17-9-18-16(12)19-10-4-3-5-11(20)6-10/h3-9,20H,1-2H3,(H,17,18,19)
InChI Key	BNDYIYYKEIXHNK-UHFFFAOYSA-N
MDL Number	MFCD02683970
Molecular Formula	C16H15N3O3
Molecular Weight	297.3086
SMILES	COC1=CC2=C(NC3=CC=CC(O)=C3)N=CN=C2C=C1OC
Synonyms	4-(3'-hydroxyphenyl)amino-6,7-dimethoxyquinazoline, JANEX 3, JANEX-3, JANEX3, WHI P180, WHI-P180, whi-p180, 211555-08-7, 3-[(6,7-dimethoxyquinazolin-4-yl)amino]phenol, JANEX 3, WHI-P180, Hydrochloride, 4-[3-HYDROXYANILINO]-6,7-DIMETHOXYQUINAZOLINE, CHEMBL127907, 3-((6,7-Dimethoxyquinazolin-4-yl)amino)phenol, AK341047, DTQ, 4-(3′-Hydroxyphenyl)amino-6,7-dimethoxyquinazoline, HCl, JANEX-3, 4btk, 1di8, AC1L1KWT, AC1Q4XVE, 3-(6,7-dimethoxyquinazolin-4-ylamino)phenol, Anilinoquinazoline deriv. 5, WHI-P180(Janex 3), BDBM4622, SCHEMBL1180103, CTK4E5981, AOB5495, BNDYIYYKEIXHNK-UHFFFAOYSA-N, HMS3229P15, BCP15153, ZINC3828650, HSCI1_000392, IN1014, MFCD02683970, AKOS002350928, CS-1702, DB03365, NCGC00379002-02, AS-35327, HY-15769, RT-016260, EC-000.2374, K00036, 3-[(6,7-Dimethoxy-4-quinazolinyl)amino]phenol, 4-(3'-hydroxyanilino)-6,7-dimethoxyquinazoline, Phenol, 3-[(6,7-dimethoxy-4-quinazolinyl)amino]-, BRD-K82708110-003-01-5, WHI-P180; 4-(3'-Hydroxyphenyl)amino-6,7-dimethoxyquinazoline, HCl, JANEX3, WHI-P180 hydrochloride, D06DQE, D0KH5T, WHI P180, CID5687, AR-1F0665, A8643, A15509, C118361, 4-(3'-hydroxyphenyl)amino-6,7-dimethoxyquinazoline, 21679-21-0,

Complexity	358
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	297.111g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	297.314g/mol
Monoisotopic Mass	297.111g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	76.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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