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Nateglinide EP Impurity G

CAT: 1299-RM-N200707-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-N200707-01Size:10 mg
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CAS Number
187728-85-4
Synonyms
N-[[trans-4- (1-Methylethyl) cyclohexyl]carbonyl]-D-phenylalanine Ethyl Ester
Molecular Formula
C21H31NO3
Molecular Weight
345.49
Target Alternative Name
Nateglinide
Product Name Synonym
N-[[trans-4- (1-Methylethyl) cyclohexyl]carbonyl]-D-phenylalanine Ethyl Ester

Chemical Information

Nateglinide Ethyl Ester
CAS Number187728-85-4
PubChem CID25000304
IUPAC Nameethyl (2R)-3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoate
Molecular FormulaC21H31NO3
Molecular Weight345.5
XLogP4.9
Topological Polar Surface Area55.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count25
Formal Charge0
Complexity421
SMILES
CCOC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C2CCC(CC2)C(C)C
InChI
InChI=1S/C21H31NO3/c1-4-25-21(24)19(14-16-8-6-5-7-9-16)22-20(23)18-12-10-17(11-13-18)15(2)3/h5-9,15,17-19H,4,10-14H2,1-3H3,(H,22,23)/t17?,18?,19-/m1/s1
InChIKey
AVOHCDLQBWDQOF-CTWPCTMYSA-N
Chemical Structure
2D Structure
2D structure of Nateglinide Ethyl Ester
CAS: 187728-85-4
CID: 25000304
Formula: C21H31NO3
MW: 345.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight345.5
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass345.23039385
Monoisotopic Mass345.23039385
Topological Polar Surface Area55.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity421
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
AR-N08374-01Nateglinide Impurity 3
AR-N08376-01Nateglinide Impurity 2
TRC-N379410-100MGNateglinide Methyl Ester Impurity
AR-N01174-01Nateglinide EP Impurity E
AR-N08377-01Nateglinide EP Impurity B (Nateglinide USP Related Compound B, ent-Nateglinide)
AR-N01173-01Nateglinide EP Impurity G
AR-N01175-01Nateglinide EP Impurity F
AR-N08378-01Nateglinide EP Impurity C (Nateglinide USP Related Compound C)
165211N-[[cis-4- (1-Methylethyl) cyclohexyl]carbonyl]-D-phenylalanine (Nateglinide Impurity)
TRC-M304905-250MGN-[[cis-4-(1-Methylethyl)cyclohexyl]carbonyl]-D-phenylalanine(Nateglinide Impurity)

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