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143722-93-4 | 2,3,5-Piperazinetrione, 1,4-bis(phenylmethyl)-
CAS No: 143722-93-4 Catalog No: AG001IA4 MDL No:
Product Description
Catalog Number:
AG001IA4
Chemical Name:
2,3,5-Piperazinetrione, 1,4-bis(phenylmethyl)-
CAS Number:
143722-93-4
Molecular Formula:
C18H16N2O3
Molecular Weight:
308.3312
IUPAC Name:
1,4-dibenzylpiperazine-2,3,5-trione
InChI:
InChI=1S/C18H16N2O3/c21-16-13-19(11-14-7-3-1-4-8-14)17(22)18(23)20(16)12-15-9-5-2-6-10-15/h1-10H,11-13H2
InChI Key:
RPMZWVFXZIGXIP-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2ccccc2)CC(=O)N(C1=O)Cc1ccccc1
Properties
Complexity:
465
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.116g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.337g/mol
Monoisotopic Mass:
308.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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