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1223-20-7 | Benzenamine, 4,4'-methylenebis[2-methoxy-
CAS No: 1223-20-7 Catalog No: AG00172T MDL No:
Product Description
Catalog Number:
AG00172T
Chemical Name:
Benzenamine, 4,4'-methylenebis[2-methoxy-
CAS Number:
1223-20-7
Molecular Formula:
C15H18N2O2
Molecular Weight:
258.3156
IUPAC Name:
4-[(4-amino-3-methoxyphenyl)methyl]-2-methoxyaniline
InChI:
InChI=1S/C15H18N2O2/c1-18-14-8-10(3-5-12(14)16)7-11-4-6-13(17)15(9-11)19-2/h3-6,8-9H,7,16-17H2,1-2H3
InChI Key:
LKHVCEWNPKEPBT-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1N)Cc1ccc(c(c1)OC)N
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.137g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.321g/mol
Monoisotopic Mass:
258.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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