200,000+ products from a single source!
sales@angenechem.com
827031-47-0 | 4-Quinazolinamine, N-(4-methoxyphenyl)-N,2-dimethyl-7-nitro-
CAS No: 827031-47-0 Catalog No: AG005A4U MDL No:
Product Description
Catalog Number:
AG005A4U
Chemical Name:
4-Quinazolinamine, N-(4-methoxyphenyl)-N,2-dimethyl-7-nitro-
CAS Number:
827031-47-0
Molecular Formula:
C17H16N4O3
Molecular Weight:
324.3339
IUPAC Name:
N-(4-methoxyphenyl)-N,2-dimethyl-7-nitroquinazolin-4-amine
InChI:
InChI=1S/C17H16N4O3/c1-11-18-16-10-13(21(22)23)6-9-15(16)17(19-11)20(2)12-4-7-14(24-3)8-5-12/h4-10H,1-3H3
InChI Key:
OTGYGJKPQCXIKZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N(c1nc(C)nc2c1ccc(c2)[N+](=O)[O-])C
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.122g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.34g/mol
Monoisotopic Mass:
324.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Discovery of N-methyl-4-(4-methoxyanilino)quinazolines as potent apoptosis inducers. Structure-activity relationship of the quinazoline ring. | Bioorganic & medicinal chemistry letters 20100401 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.