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88011-55-6

88011-55-6 | Urea, N-methyl-N'-[3-(3-methyl-2,5-dioxo-1-pyrrolidinyl)phenyl]-

CAS No: 88011-55-6 Catalog No: AG004H06 MDL No:

Product Description

Catalog Number:
AG004H06
Chemical Name:
Urea, N-methyl-N'-[3-(3-methyl-2,5-dioxo-1-pyrrolidinyl)phenyl]-
CAS Number:
88011-55-6
Molecular Formula:
C13H15N3O3
Molecular Weight:
261.2765
IUPAC Name:
1-methyl-3-[3-(3-methyl-2,5-dioxopyrrolidin-1-yl)phenyl]urea
InChI:
InChI=1S/C13H15N3O3/c1-8-6-11(17)16(12(8)18)10-5-3-4-9(7-10)15-13(19)14-2/h3-5,7-8H,6H2,1-2H3,(H2,14,15,19)
InChI Key:
BNMSMENPTLGZGA-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1cccc(c1)N1C(=O)CC(C1=O)C

Properties

Complexity:
397  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.111g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.281g/mol
Monoisotopic Mass:
261.111g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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