2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-thiophen-3-ylacetic acid


Chemical Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-thiophen-3-ylacetic acid
CAS Number: 885274-75-9
Product Number: AG0089GL(AGN-PC-0KKORR)
Synonyms:
MDL No:
Molecular Formula: C15H22N2O4S
Molecular Weight: 326.4112

Identification/Properties


Computed Properties
Molecular Weight:
326.411g/mol
XLogP3:
-0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
326.13g/mol
Monoisotopic Mass:
326.13g/mol
Topological Polar Surface Area:
98.3A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
416
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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