AG009AR5

1426129-50-1 | LCZ696 InteMediate

AG009AR5

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CAS Number	1426129-50-1
Catalog Number	AG009AR5(AGN-PC-0WAMHV)
Chemical Name	LCZ696 InteMediate
IUPAC Name	tert-butyl N-[(2R)-1-hydroxy-3-(4-phenylphenyl)propan-2-yl]carbamate
InChI	InChI=1S/C20H25NO3/c1-20(2,3)24-19(23)21-18(14-22)13-15-9-11-17(12-10-15)16-7-5-4-6-8-16/h4-12,18,22H,13-14H2,1-3H3,(H,21,23)/t18-/m1/s1
InChI Key	TYQICOFAZDVKMK-GOSISDBHSA-N
MDL Number	MFCD28359221
Molecular Formula	C20H25NO3
Molecular Weight	327.4174
SMILES	O=C(OC(C)(C)C)N[C@@H](CO)CC1=CC=C(C2=CC=CC=C2)C=C1
Synonyms	1426129-50-1, (R)-tert-butyl (1-([1,1'-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbaMate, LCZ696 InteMediate, (R)-tert-butyl(1-([1,1-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbamate, N-[(1R)-2-[1,1'-Biphenyl]-4-yl-1-(hydroxymethyl)ethyl]carbamic acid 1,1-dimethylethyl ester, AMBZ0391, (S)-tert-Butyl (1-([1,1'-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbamate, SCHEMBL15521493, TYQICOFAZDVKMK-GOSISDBHSA-N, 153037-40-2, BCP11506, MFCD28359221, ZINC98091052, AKOS027307888, ACN-036827, AM85577, KS-00000L52, AC-28983, DS-11243, (R)-t-Butyl 1-(biphenyl-4-yl)-3-hydroxypropan-2-ylcarbamate, (2-Biphenyl-4-yl-1-hydroxymethyl-ethyl)-carbamic acid tert-butyl ester, (R)-tert-butyl (1-([1,1-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbamate, (R)-TERT-BUTYL 1-(BIPHENYL-4-YL)-3-HYDROXYPROPAN-2-YLCARBAMATE, (R)-tert-butyl-(1-([1,1-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbamate, tert-butyl (R)-(1-([1,1'-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbamate, tert-butyl N-[(2R)-1-hydroxy-3-(4-phenylphenyl)propan-2-yl]carbamate, [(R)-2-(4-Biphenylyl)-1-(hydroxymethyl)ethyl]carbamic acid tert-butyl ester, (R)-tert-butyl (1-([1,1'-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbaMate; (R)-tert-butyl(1-([1,1-biphenyl]-4-yl)-3-hydroxypropan-2-yl)carbamate, N-[(1R)-2-[1,1\'-Biphenyl]-4-yl-1-(hydroxymethyl)ethyl]carbamic acid 1,1-dimethylethyl ester, CS-O-14054,

Complexity	377
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	327.183g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	327.424g/mol
Monoisotopic Mass	327.183g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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