200,000+ products from a single source!
sales@angenechem.com
198649-71-7 | Benzenesulfonamide, 4-[[(6-chloro-4-oxo-4H-1-benzopyran-3-yl)methylene]amino]-N-[(phenylamino)carbonyl]-
CAS No: 198649-71-7 Catalog No: AG002BNR MDL No:
Product Description
Catalog Number:
AG002BNR
Chemical Name:
Benzenesulfonamide, 4-[[(6-chloro-4-oxo-4H-1-benzopyran-3-yl)methylene]amino]-N-[(phenylamino)carbonyl]-
CAS Number:
198649-71-7
Molecular Formula:
C23H16ClN3O5S
Molecular Weight:
481.9082
IUPAC Name:
1-[4-[(6-chloro-4-oxochromen-3-yl)methylideneamino]phenyl]sulfonyl-3-phenylurea
InChI:
InChI=1S/C23H16ClN3O5S/c24-16-6-11-21-20(12-16)22(28)15(14-32-21)13-25-17-7-9-19(10-8-17)33(30,31)27-23(29)26-18-4-2-1-3-5-18/h1-14H,(H2,26,27,29)
InChI Key:
HJLDIVJARSLWBK-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(=O)c(co2)C=Nc1ccc(cc1)S(=O)(=O)NC(=O)Nc1ccccc1
Properties
Complexity:
886
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
481.05g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
481.907g/mol
Monoisotopic Mass:
481.05g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.