AG00FC10

694433-59-5 | 2-(5-Benzo[1,3]dioxol-5-yl-2-tert-butyl-3H-imidazol-4-yl)-6-methylpyridine hydrate hydrochloride

AG00FC10

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CAS Number	694433-59-5
Catalog Number	AG00FC10(AGN-PC-0MUOWM)
Chemical Name	2-(5-Benzo[1,3]dioxol-5-yl-2-tert-butyl-3H-imidazol-4-yl)-6-methylpyridine hydrate hydrochloride
IUPAC Name	2-[4-(1,3-benzodioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl]-6-methylpyridine
InChI	InChI=1S/C20H21N3O2/c1-12-6-5-7-14(21-12)18-17(22-19(23-18)20(2,3)4)13-8-9-15-16(10-13)25-11-24-15/h5-10H,11H2,1-4H3,(H,22,23)
InChI Key	WGZOTBUYUFBEPZ-UHFFFAOYSA-N
MDL Number	MFCD20926329
Molecular Formula	C20H21N3O2
Molecular Weight	335.3996
SMILES	O1COC2=C1C=CC(=C2)C=2N=C(NC2C2=NC(=CC=C2)C)C(C)(C)C
Synonyms	2-(5-benzo(1,3)dioxol-5-yl-2-tert-butyl-3H-imidazol-4-yl)-6-methylpyridine hydrochloride, SB-505124, SB505124, SB-505124, 694433-59-5, SB505124, SB 505124, 2-(4-(benzo[d][1,3]dioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl)-6-methylpyridine, CHEMBL226838, 2-(5-benzo[1,3]dioxol-5-yl-2-tert-butyl-3h-imidazol-4-yl)-6-methylpyridine, 2-(5-(benzo[d][1,3]dioxol-5-yl)-2-tert-butyl-1H-imidazol-4-yl)-6-methylpyridine, 2-[4-(1,3-Benzodioxol-5-yl)-2-(tert-butyl)-1H-imidazol-5-yl]-6-methylpyridine, 2-[4-(2H-1,3-benzodioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl]-6-methylpyridine, 2-[5-(1,3-Benzodioxol-5-yl)-2-(1,1-dimethylethyl)-1H-imidazol-4-yl]-6-methylpyridine, MLS006010969, SCHEMBL373422, GTPL6049, CTK8E3615, KS-00000XPS, AOB1766, AOB5688, DTXSID50431926, EX-A217, CHEBI:100922, BCPP000071, HMS3655F08, BCP22718, 2707AH, BDBM50298220, MFCD20926329, s2186, ZINC16052825, AKOS024457513, API0010255, CS-1582, RTX-012858, SB19487, 2-[4-(1,3-benzodioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl]-6-methylpyridine, NCGC00165889-01, NCGC00165889-02, AC-27412, AK286365, BC600335, HY-13521, SC-96721, SMR004702773, BCP0726000127, SW219461-1, 2-(4-(benzo[d][1,3]dioxol-5-yl)-2-(tert-butyl)-1H-imidazol-5-yl)-6-methylpyridine, 2-[4-(1,3-benzodioxol-5-yl)-2-(1,1-dimethylethyl)-1H-imidazol-5-yl]-6-methyl-pyridin, 2-[4-(1,3-Benzodioxol-5-yl)-2-(1,1-dimethylethyl)-1H-imidazol-5-yl]-6-methyl-pyridine, 2-(5-Benzo[1,3]dioxol-5-yl-2-tert-butyl-3H-imidazol-4-yl)-6-methylpyridine hydrate hydrochloride, D0Q5UH, SB-505124 hydrochloride, TGF-beta RI Inhibitor III, CHEMBL1824446, C20H21N3O2, CID9858940, B2289, A11157, C519132, 356559-13-2, 2-(5-benzo(1,3)dioxol-5-yl-2-tert-butyl-3H-imidazol-4-yl)-6-methylpyridine hydrochloride, 2-(5-benzo[1,3]dioxol-5-yl-2-tert-butyl-3H-imidazol-4-yl)-6-methyl-pyridine, 2-(5-benzo[1,3]dioxol-5-yl-2-tert-butyl-3h-imidazol-4-yl)-6-methylpyridine hydrochloride, SB-505124, 98%, a selective inhibitor of TGFbetaR for ALK4, ALK5 - 10MG 10mg,

Complexity	466
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	335.163g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	335.407g/mol
Monoisotopic Mass	335.163g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	60A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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