200,000+ products from a single source!
sales@angenechem.com
99844-02-7 | 4-(4-Methoxyphenyl);pyrimidin-2-amine
CAS No: 99844-02-7 Catalog No: AG003W19 MDL No:MFCD00665912
Product Description
Catalog Number:
AG003W19
Chemical Name:
4-(4-Methoxyphenyl);pyrimidin-2-amine
CAS Number:
99844-02-7
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
MDL Number:
MFCD00665912
IUPAC Name:
4-(4-methoxyphenyl)pyrimidin-2-amine
InChI:
InChI=1S/C11H11N3O/c1-15-9-4-2-8(3-5-9)10-6-7-13-11(12)14-10/h2-7H,1H3,(H2,12,13,14)
InChI Key:
GHSMJZASRNAUBJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1ccnc(n1)N
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Identification of novel isocytosine derivatives as xanthine oxidase inhibitors from a set of virtual screening hits. | Bioorganic & medicinal chemistry 20120501 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.