200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 133208-20-5
133208-20-5 | Urea, N,N''-(sulfonyldi-4,1-phenylene)bis[N'-phenyl- (9CI)
CAS No: 133208-20-5 Catalog No: AG0014EI MDL No:
Product Description
Catalog Number:
AG0014EI
Chemical Name:
Urea, N,N''-(sulfonyldi-4,1-phenylene)bis[N'-phenyl- (9CI)
CAS Number:
133208-20-5
Molecular Formula:
C26H22N4O4S
Molecular Weight:
486.5423
IUPAC Name:
1-phenyl-3-[4-[4-(phenylcarbamoylamino)phenyl]sulfonylphenyl]urea
InChI:
InChI=1S/C26H22N4O4S/c31-25(27-19-7-3-1-4-8-19)29-21-11-15-23(16-12-21)35(33,34)24-17-13-22(14-18-24)30-26(32)28-20-9-5-2-6-10-20/h1-18H,(H2,27,29,31)(H2,28,30,32)
InChI Key:
WPIXSHXQOCVBMT-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)Nc1ccc(cc1)S(=O)(=O)c1ccc(cc1)NC(=O)Nc1ccccc1
Properties
Complexity:
727
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
486.136g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
486.546g/mol
Monoisotopic Mass:
486.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.