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207612-91-7 | Glycine, N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]-N-[2-(1,1-dimethylethoxy)-2-oxoethyl]-, 1,1-dimethylethyl ester
CAS No: 207612-91-7 Catalog No: AG002J5R MDL No:
Product Description
Catalog Number:
AG002J5R
Chemical Name:
Glycine, N-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl]-N-[2-(1,1-dimethylethoxy)-2-oxoethyl]-, 1,1-dimethylethyl ester
CAS Number:
207612-91-7
Molecular Formula:
C18H28N2O6
Molecular Weight:
368.4247
IUPAC Name:
tert-butyl 2-[2-(2,5-dioxopyrrol-1-yl)ethyl-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate
InChI:
InChI=1S/C18H28N2O6/c1-17(2,3)25-15(23)11-19(12-16(24)26-18(4,5)6)9-10-20-13(21)7-8-14(20)22/h7-8H,9-12H2,1-6H3
InChI Key:
BTBBUJWMZNKNEJ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CN(CC(=O)OC(C)(C)C)CCN1C(=O)C=CC1=O
Properties
Complexity:
550
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.195g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.43g/mol
Monoisotopic Mass:
368.195g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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