AG002CEB

199864-87-4 | 2-Pyrimidinamine, 4-(4-fluoro-1-naphthalenyl)-6-(1-methylethyl)-

AG002CEB

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CAS Number	199864-87-4
Catalog Number	AG002CEB(AGN-PC-0JNNQG)
Chemical Name	2-Pyrimidinamine, 4-(4-fluoro-1-naphthalenyl)-6-(1-methylethyl)-
IUPAC Name	4-(4-fluoronaphthalen-1-yl)-6-propan-2-ylpyrimidin-2-amine
InChI	InChI=1S/C17H16FN3/c1-10(2)15-9-16(21-17(19)20-15)13-7-8-14(18)12-6-4-3-5-11(12)13/h3-10H,1-2H3,(H2,19,20,21)
InChI Key	ZZZQXCUPAJFVBN-UHFFFAOYSA-N
MDL Number	MFCD11112196
Molecular Formula	C17H16FN3
Molecular Weight	281.3274
SMILES	NC1=NC(C(C)C)=CC(C2=C3C=CC=CC3=C(F)C=C2)=N1
UNII	0JAU3P8OBM
Synonyms	2-amino-4-(4-fluoronaphth-1-yl)-6-isopropylpyrimidine, MT 500, MT-500, MT500 cpd, RS 127445, RS 27354, RS-127445, RS-27354, RS127445, RS27354, 199864-87-4, RS-127445, RS 127445, 4-(4-fluoronaphthalen-1-yl)-6-isopropylpyrimidin-2-amine, UNII-0JAU3P8OBM, MT 500, 0JAU3P8OBM, CHEMBL473186, C17H16FN3, RS-127445 HCl, 2-Pyrimidinamine, 4-(4-fluoro-1-naphthalenyl)-6-(1-methylethyl)-, 2-Amino-4-(4-fluoronaphth-1-yl)-6-isopropylpyrimidine, 4-(4-fluoronaphthalen-1-yl)-6-propan-2-ylpyrimidin-2-amine, AK112028, RS127445, RS-127,445, AC1L52MZ, GTPL188, RS 127445 hydrochloride/, SCHEMBL375979, ZZZQXCUPAJFVBN-UHFFFAOYSA-N, BCPP000085, HMS3651H11, MT500, BCP02714, ZINC3961115, ABP000805, BDBM50249134, s2698, AKOS016007881, SB19507, NCGC00386190-05, 4CA-1114, AJ-47542, AB0033844, AX8242724, ST2405382, SW219736-1, X7621, RS-127445-190, L000524, J-012919, 2-Amino-4-(4-fluoronaphth-1-yl)-6-isopropyl-pyrimidine, 4-(4-Fluoro-1-naphthyl)-6-isopropylpyrimidin-2-amine, Pyrimidine, 2-amino-4-(4-fluoronaphth-1-yl)-6-isopropyl-, 199864-87-4 pound not RS127445 pound not RS 127445, 4-(4-Fluoro-1-naphthalenyl)-6-(1-methylethyl)-2-pyrimidinamine hydrochloride;RS-127,445, D0QF4Z, RS 127445 hydrochloride, C17-H16-F-N3, CID196968, MT-500, 199864-86-3, 4-(4-Fluoronaphthalen-1-yl)-6-isopropylpyrimidin-2-amine hydrochloride, 4-(4-Fluoro-1-naphthalenyl)-6-(1-methylethyl)-2-pyrimidinamine hydrochloride, 13292-46-1,

Complexity	349
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	281.133g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	281.334g/mol
Monoisotopic Mass	281.133g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	51.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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