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148806-87-5 | Urea, N-cyclohexyl-N'-(4-methoxyphenyl)-
CAS No: 148806-87-5 Catalog No: AG001L81 MDL No:
Product Description
Catalog Number:
AG001L81
Chemical Name:
Urea, N-cyclohexyl-N'-(4-methoxyphenyl)-
CAS Number:
148806-87-5
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
IUPAC Name:
1-cyclohexyl-3-(4-methoxyphenyl)urea
InChI:
InChI=1S/C14H20N2O2/c1-18-13-9-7-12(8-10-13)16-14(17)15-11-5-3-2-4-6-11/h7-11H,2-6H2,1H3,(H2,15,16,17)
InChI Key:
KZOFCHITIRGEGY-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)NC1CCCCC1
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Optimization of amide-based inhibitors of soluble epoxide hydrolase with improved water solubility. | Journal of medicinal chemistry 20050519 |
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