AG0023ET

1821428-35-6 | 2H-Imidazo[4,5-c]quinolin-2-one, 8-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-1,3-dihydro-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-

AG0023ET

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CAS Number	1821428-35-6
Catalog Number	AG0023ET(AGN-PC-0WGCTA)
Chemical Name	2H-Imidazo[4,5-c]quinolin-2-one, 8-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-1,3-dihydro-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-
IUPAC Name	8-[6-[3-(dimethylamino)propoxy]pyridin-3-yl]-3-methyl-1-(oxan-4-yl)imidazo[4,5-c]quinolin-2-one
InChI	InChI=1S/C26H31N5O3/c1-29(2)11-4-12-34-24-8-6-19(16-28-24)18-5-7-22-21(15-18)25-23(17-27-22)30(3)26(32)31(25)20-9-13-33-14-10-20/h5-8,15-17,20H,4,9-14H2,1-3H3
InChI Key	AOTRIQLYUAFVSC-UHFFFAOYSA-N
MDL Number	MFCD30470661
Molecular Formula	C26H31N5O3
Molecular Weight	461.5560
SMILES	CN(CCCOC1=CC=C(C=N1)C1=CC=2C3=C(C=NC2C=C1)N(C(N3C3CCOCC3)=O)C)C
UNII	P5T0XWC07Z
Synonyms	8-(6-(3-(Dimethylamino)propoxy)pyridin-3-yl)-3-methyl-1-(tetrahydro-2 H-pyran-4-yl)-1,3-dihydro-2 H-imidazo(4,5- c)quinolin-2-one, AZD-0156, AZD0156, AZD0156, 1821428-35-6, AZD-0156, UNII-P5T0XWC07Z, P5T0XWC07Z, azd0156-azd-0156, GTPL9942, CHEMBL3960662, SCHEMBL17246146, AOTRIQLYUAFVSC-UHFFFAOYSA-N, AZD 0156 [WHO-DD], BDBM245474, BCP18990, EX-A1321, MFCD30470661, s8375, AKOS030629510, ZINC498035578, CS-5889, SB19769, AZD0156 (AZD-0156), AS-35329, compound 64 [PMID: 29683659], HY-100016, A16419, US9428503, 1, 2H-Imidazo[4,5-c]quinolin-2-one, 8-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-1,3-dihydro-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-, 8-(6-(3-(dimethylamino)propoxy)pyridin-3-yl)-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-imidazo[4,5-c]quinolin-2(3H)-one, 8-[6-(3-Dimethylaminopropoxy)pyridin-3-yl]-3-methyl-1-(oxan-4-yl)imidazo[5,4-c]quinolin-2-one, 8-[6-[3-(dimethylamino)propoxy]pyridin-3-yl]-3-methyl-1-(oxan-4-yl)imidazo[4,5-c]quinolin-2-one,

Complexity	687
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	461.243g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	461.566g/mol
Monoisotopic Mass	461.243g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	71A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

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

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