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87898-63-3

87898-63-3 | Propanediamide, 2-oxo-N,N,N',N'-tetrakis(phenylmethyl)-

CAS No: 87898-63-3 Catalog No: AG004FWR MDL No:

Product Description

Catalog Number:
AG004FWR
Chemical Name:
Propanediamide, 2-oxo-N,N,N',N'-tetrakis(phenylmethyl)-
CAS Number:
87898-63-3
Molecular Formula:
C31H28N2O3
Molecular Weight:
476.5656
IUPAC Name:
N,N,N',N'-tetrabenzyl-2-oxopropanediamide
InChI:
InChI=1S/C31H28N2O3/c34-29(30(35)32(21-25-13-5-1-6-14-25)22-26-15-7-2-8-16-26)31(36)33(23-27-17-9-3-10-18-27)24-28-19-11-4-12-20-28/h1-20H,21-24H2
InChI Key:
PLHKOVPOKDQERX-UHFFFAOYSA-N
SMILES:
O=C(C(=O)N(Cc1ccccc1)Cc1ccccc1)C(=O)N(Cc1ccccc1)Cc1ccccc1

Properties

Complexity:
601  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
476.21g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
476.576g/mol
Monoisotopic Mass:
476.21g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  

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