AG007RXB

187523-35-9 | (S)-3-(5-Chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)indolin-2-one

AG007RXB

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CAS Number	187523-35-9
Catalog Number	AG007RXB(AGN-PC-0QGKXB)
Chemical Name	(S)-3-(5-Chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)indolin-2-one
IUPAC Name	(3S)-3-(5-chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)-1H-indol-2-one
InChI	InChI=1S/C16H10ClF4NO2/c1-24-13-5-3-9(17)7-11(13)15(18)10-4-2-8(16(19,20)21)6-12(10)22-14(15)23/h2-7H,1H3,(H,22,23)/t15-/m0/s1
InChI Key	ULYONBAOIMCNEH-HNNXBMFYSA-N
MDL Number	MFCD09475617
Molecular Formula	C16H10ClF4NO2
Molecular Weight	359.7027
SMILES	ClC=1C=CC(=C(C1)[C@@]1(C(NC2=CC(=CC=C12)C(F)(F)F)=O)F)OC
UNII	J57O328W4W
Synonyms	(5-chloro-2-methoxyphenyl)-1,3-dihydro-3-fluoro-6-(trifluoromethyl)-2H-indol-2-one, BMS 204352, BMS-204352, BMS204352, MaxiPost, Flindokalner, MaxiPost, BMS-204352, 187523-35-9, Flindokalner [USAN:INN], BMS 204352, UNII-J57O328W4W, (3S)-3-(5-Chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one, J57O328W4W, (s)-3-(5-chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)indolin-2-one, 2H-Indol-2-one, 3-(5-chloro-2-methoxyphenyl)-3-fluoro-1,3-dihydro-6-(trifluoromethyl)-, (3S)-, Maxipost (TN), (3S)-3-(5-chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)-1H-indol-2-one, (S)-3-(5-Chloro-2-methoxy-phenyl)-3-fluoro-6-trifluoromethyl-1,3-dihydro-indol-2-one, 2H-Indol-2-one,3-(5-chloro-2-methoxyphenyl)-3-fluoro-1,3-dihydro-6-(trifluoromethyl)-, (3S)-, Bms204352, Flindokalner (USAN/INN), AC1Q4JQL, AC1L4WO7, (S)-II, CHEMBL266510, GTPL2307, SCHEMBL4877314, CTK4D9553, ULYONBAOIMCNEH-HNNXBMFYSA-N, ZINC839816, BDBM50426567, AKOS024458430, SB19641, LS-185930, B7722, C13830, D04192, BMS 204352, >=98% (HPLC), BMS 204352, (S)-(+)-, (S)-3-(5-chloro-2-methoxyphenyl)-3-fluoro-6-(trifluoromethyl)-indolin-2-one, (3S)-3-(5-Chloro-2-methoxyphenyl)-3-fluoro-1,3-dihydro-6-(trifluoromethyl)-2H-Indol-2-one, (+)-MAXIPOST, D0S6QR, C16H10ClF4NO2, KST-1A2724, C16-H10-Cl-F4-N-O2, AR-1A4469, CID214350, C424388, 21555-18-0, (5-chloro-2-methoxyphenyl)-1,3-dihydro-3-fluoro-6-(trifluoromethyl)-2H-indol-2-one, (3S)-(+)-(5-Chloro-2-methoxyphenyl)-1,3-dihydro-3-fluoro-6-(trifluoromethyl)-2H-indol-2-one, 183720-28-7,

Complexity	503
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	359.034g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	359.705g/mol
Monoisotopic Mass	359.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P280-P304+P340+P312-P305+P351+P338-P337+P313
UN Code	\N

Certificate of Analysis

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