4'- Methoxy-[1,1'-biphenyl] - 4- methanamine - CAS 769073-20-3
Catalog: |
BB060197 |
Product Name: |
4'- Methoxy-[1,1'-biphenyl] - 4- methanamine |
CAS: |
769073-20-3 |
Synonyms: |
[4-(4-methoxyphenyl)phenyl]methanamine; 4'-Methoxy-biphenyl-4-methanamine; (4'-Methoxy-[1,1'-biphenyl]-4-yl)methanamine; 4'-Methoxy-[1,1'-biphenyl]-4-methanamine; (4'-Methoxybiphenyl-4-yl)methanamine |
IUPAC Name: | [4-(4-methoxyphenyl)phenyl]methanamine |
Description: | 4'- Methoxy-[1,1'-biphenyl] - 4- methanamine is used to prepare biphenylmethyl urea derivatves as MCH-R1 antagonists for reatment of obesity. It is also used to synthesize the Pseudomonas aeruginosa virulence factor LasB inhibitors. |
Molecular Weight: | 213.28 |
Molecular Formula: | C14H15NO |
Canonical SMILES: | COC1=CC=C(C=C1)C2=CC=C(C=C2)CN |
InChI: | InChI=1S/C14H15NO/c1-16-14-8-6-13(7-9-14)12-4-2-11(10-15)3-5-12/h2-9H,10,15H2,1H3 |
InChI Key: | IWMYHDWDAGSRFY-UHFFFAOYSA-N |
References: | Galiano, S., et al. Bioorg. Med. Chem., 15, 3896 (2007); Garner, A>, et al. ACS Med. Chem. Lett., 3, 668 (2012). |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 213.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.115364102 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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