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13262-44-7 | Urea, N-(2,6-dimethylphenyl)-N'-phenyl-
CAS No: 13262-44-7 Catalog No: AG0010X3 MDL No:
Product Description
Catalog Number:
AG0010X3
Chemical Name:
Urea, N-(2,6-dimethylphenyl)-N'-phenyl-
CAS Number:
13262-44-7
Molecular Formula:
C15H16N2O
Molecular Weight:
240.3003
IUPAC Name:
1-(2,6-dimethylphenyl)-3-phenylurea
InChI:
InChI=1S/C15H16N2O/c1-11-7-6-8-12(2)14(11)17-15(18)16-13-9-4-3-5-10-13/h3-10H,1-2H3,(H2,16,17,18)
InChI Key:
KQUIMGLCJSOHFO-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(C)cccc1C)Nc1ccccc1
NSC Number:
136976
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.306g/mol
Monoisotopic Mass:
240.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Unsymmetrically disubstituted urea derivatives: a potent class of antiglycating agents. | Bioorganic & medicinal chemistry 20090315 |
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