AG000PE9

119637-67-1 | ethyl 3-[2-(2-methoxyphenoxymethyl)-1,3-thiazolidin-3-yl]-3-oxopropanoate

AG000PE9

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CAS Number	119637-67-1
Catalog Number	AG000PE9(AGN-PC-0JL6WK)
Chemical Name	ethyl 3-[2-(2-methoxyphenoxymethyl)-1,3-thiazolidin-3-yl]-3-oxopropanoate
IUPAC Name	ethyl 3-[2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-3-oxopropanoate
InChI	InChI=1S/C16H21NO5S/c1-3-21-16(19)10-14(18)17-8-9-23-15(17)11-22-13-7-5-4-6-12(13)20-2/h4-7,15H,3,8-11H2,1-2H3
InChI Key	WSYVIAQNTFPTBI-UHFFFAOYSA-N
MDL Number	MFCD00866839
Molecular Formula	C16H21NO5S
Molecular Weight	339.4066
NSC Number	759829
SMILES	O=C(OCC)CC(N1C(COC2=CC=CC=C2OC)SCC1)=O
Synonyms	2-(2-methoxyphenoxy)methyl-3-ethoxycarbonylacetyl-1,3-thiazolidine, BBR 2173, BBR-2173, ethyl 2-((2-methoxyphenoxy)methyl)-beta-oxothiazolidine-3-propanoate, moguisteine, Moguisteine, 119637-67-1, BBR-2173, Moguisteine [INN], Moguisteinum [INN-Latin], Moguisteina [INN-Spanish], C16H21NO5S, Ethyl 2-((2-methoxyphenoxy)methyl)-beta-oxo-3-thiazolidinepropanoate (+-)-, R,S(+-)-2-(2-Methoxyphenoxy)-methyl-3-ethoxycarbonylacetyl-1,3-thiazolidine, 3-Thiazolidinepropanoic acid, 2-((2-methoxyphenoxy)methyl)-beta-oxo-, ethyl ester, (+-)-, Moguisteina, Moguisteinum, Ethyl (+-)-2-((o-methoxyphenoxy)methyl)-beta-oxo-3-thiazolidinepropionate, ethyl 3-(2-((2-methoxyphenoxy)methyl)thiazolidin-3-yl)-3-oxopropanoate, ethyl 3-[2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-3-oxopropanoate, Ethyl 3-{2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl}-3-oxopropanoate, BBR 2173, ACMC-20d7cg, AC1Q5JZ1, Oprea1_020741, MLS006010420, SCHEMBL358534, AC1L24A2, CHEMBL146980, CTK8E8094, 3-Thiazolidinepropanoicacid, 2-[(2-methoxyphenoxy)methyl]-b-oxo-, ethyl ester, (R)- (9CI), HMS3264I22, HMS3651H22, Pharmakon1600-01502311, BCP05219, EBD54061, HY-B0505, KS-00001F7I, 2-(2-methoxyphenoxy)methyl-3-ethoxycarbonylacetyl-1,3-thiazolidine, ethyl 2-((2-methoxyphenoxy)methyl)-beta-oxothiazolidine-3-propanoate, MFCD00866839, NSC759829, s3104, AKOS015843415, AC-4727, AN-6527, BCP9000958, CCG-213816, CS-2706, KS-5161, NSC-759829, RTC-070944, VA11319, 121GE004, AK343774, SMR002529585, LS-151527, TC-070944, FT-0084586, FT-0656011, SW219622-1, BBR2173;BBR 2173;BBR-2173, K-1384, AB01563359_01, AB01563359_02, 637M671, A804330, SR-01000944248, I06-1738, J-004167, SR-01000944248-1, BRD-A87673115-001-01-7, (+/-)-2-(2-Methoxyphenoxy)-methyl-3-ethoxycarbonylacetyl-1,3-thiazolidine, (R,S)-2-(2-Methoxyphenoxy)-methyl-3-ethoxycarbonyl-acetyl-1,3 thiazolidine, ethyl 3-[2-[(2-methoxyphenoxy)methyl]thiazolidin-3-yl]-3-oxo-propanoate, (+/-)-2-[(2-Methoxyphenoxy)methyl]-|A-oxo-3-thiazolidinepropanoic Acid Ethyl Ester, 3-[2-[(2-methoxyphenoxy)methyl]-3-thiazolidinyl]-3-oxopropanoic acid ethyl ester, 3-Thiazolidinepropanoic acid, 2-[(2-methoxyphenoxy)methyl]-beta-oxo-, ethyl ester, 3-Thiazolidinepropanoicacid, 2-[(2-methoxyphenoxy)methyl]-b-oxo-, ethyl ester, ethyl 3-[2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-3-oxidanylidene-propanoate, (+/-)-2-(2-Methoxyphenoxy)-methyl-3-ethoxycarbonylacetyl-1,3-thiazolidine; (R,S)-2-(2-Methoxyphenoxy)-methyl-3-ethoxycarbonyl-acetyl-1,3 thiazolidine, ethyl( inverted exclamation markA)-2-((o-methoxyphenoxy)methyl)-b-oxo-3-thiazolidinepropionate, R(+)-Moguisteine, S(-)-Moguisteine, D0TR0Z, Moguisteine < Rec INN >, UNII-6Y556547YY, BBR 2221, BBR 2222, CID65935, C16-H21-N-O5-S, 6Y556547YY, ACN-040065, C087933, 126145-23-1, Ethyl (R)-2-((2-methoxyphenoxy)methyl)-beta-oxo-3-thiazolidinepropanoate, Ethyl (S)-2-((2-methoxyphenoxy)methyl)-beta-oxo-3-thiazolidinepropanoate, Rac-3-[2-(Ethoxycarbonyl)acetyl]-2-(2-methoxyphenoxymethyl)thiazolidine, Rac-2-[(2-Methoxyphenoxy)methyl]-beta-oxo-3-thiazolidinepropionic acid ethyl ester, 177313-65-4,

Complexity	406
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	339.114g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	339.406g/mol
Monoisotopic Mass	339.114g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	90.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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