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10128-51-5 | Benzenesulfonamide, N-[2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-
CAS No: 10128-51-5 Catalog No: AG00044T MDL No:
Product Description
Catalog Number:
AG00044T
Chemical Name:
Benzenesulfonamide, N-[2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-
CAS Number:
10128-51-5
Molecular Formula:
C20H14N2O4S
Molecular Weight:
378.4012
IUPAC Name:
N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]benzenesulfonamide
InChI:
InChI=1S/C20H14N2O4S/c23-20-16-11-5-6-12-17(16)21-19(26-20)15-10-4-7-13-18(15)22-27(24,25)14-8-2-1-3-9-14/h1-13,22H
InChI Key:
HFLJZGUOTHQWKM-UHFFFAOYSA-N
SMILES:
O=c1oc(nc2c1cccc2)c1ccccc1NS(=O)(=O)c1ccccc1
Properties
Complexity:
679
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.067g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
378.402g/mol
Monoisotopic Mass:
378.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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