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205935-12-2 | Guanidine, N-[3-(phenylmethoxy)phenyl]-
CAS No: 205935-12-2 Catalog No: AG002AF8 MDL No:
Product Description
Catalog Number:
AG002AF8
Chemical Name:
Guanidine, N-[3-(phenylmethoxy)phenyl]-
CAS Number:
205935-12-2
Molecular Formula:
C14H15N3O
Molecular Weight:
241.2884
IUPAC Name:
2-(3-phenylmethoxyphenyl)guanidine
InChI:
InChI=1S/C14H15N3O/c15-14(16)17-12-7-4-8-13(9-12)18-10-11-5-2-1-3-6-11/h1-9H,10H2,(H4,15,16,17)
InChI Key:
FDLXZFWWHUOYOB-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1cccc(c1)OCc1ccccc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.122g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.294g/mol
Monoisotopic Mass:
241.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Design, synthesis and evaluation of potential inhibitors of HIV gp120-CD4 interactions. | Bioorganic & medicinal chemistry letters 20040517 |
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