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1226-63-7 | Urea, N,N'-bis(2-methoxyphenyl)-
CAS No: 1226-63-7 Catalog No: AG0017J8 MDL No:MFCD00086673
Product Description
Catalog Number:
AG0017J8
Chemical Name:
Urea, N,N'-bis(2-methoxyphenyl)-
CAS Number:
1226-63-7
Molecular Formula:
C15H16N2O3
Molecular Weight:
272.2991
MDL Number:
MFCD00086673
IUPAC Name:
1,3-bis(2-methoxyphenyl)urea
InChI:
InChI=1S/C15H16N2O3/c1-19-13-9-5-3-7-11(13)16-15(18)17-12-8-4-6-10-14(12)20-2/h3-10H,1-2H3,(H2,16,17,18)
InChI Key:
AXLDWMVASPWDQF-UHFFFAOYSA-N
SMILES:
COc1ccccc1NC(=O)Nc1ccccc1OC
NSC Number:
164419
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.304g/mol
Monoisotopic Mass:
272.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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