200,000+ products from a single source!
sales@angenechem.com
113849-22-2 | Benzenesulfonamide, 4-(4-oxo-2-phenyl-3(4H)-quinazolinyl)-N-[(phenylamino)carbonyl]-
CAS No: 113849-22-2 Catalog No: AG0009W8 MDL No:
Product Description
Catalog Number:
AG0009W8
Chemical Name:
Benzenesulfonamide, 4-(4-oxo-2-phenyl-3(4H)-quinazolinyl)-N-[(phenylamino)carbonyl]-
CAS Number:
113849-22-2
Molecular Formula:
C27H20N4O4S
Molecular Weight:
496.5371
IUPAC Name:
1-[4-(4-oxo-2-phenylquinazolin-3-yl)phenyl]sulfonyl-3-phenylurea
InChI:
InChI=1S/C27H20N4O4S/c32-26-23-13-7-8-14-24(23)29-25(19-9-3-1-4-10-19)31(26)21-15-17-22(18-16-21)36(34,35)30-27(33)28-20-11-5-2-6-12-20/h1-18H,(H2,28,30,33)
InChI Key:
JLMGMCVNHMOVSN-UHFFFAOYSA-N
SMILES:
O=C(NS(=O)(=O)c1ccc(cc1)n1c(nc2c(c1=O)cccc2)c1ccccc1)Nc1ccccc1
Properties
Complexity:
926
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
496.121g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
496.541g/mol
Monoisotopic Mass:
496.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.