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83202-22-6 | (NZ)-N-[(4Z)-4-(benzenesulfonylimino)naphthalen-1-ylidene]benzenesulfonamide
CAS No: 83202-22-6 Catalog No: AG0050DJ MDL No:
Product Description
Catalog Number:
AG0050DJ
Chemical Name:
(NZ)-N-[(4Z)-4-(benzenesulfonylimino)naphthalen-1-ylidene]benzenesulfonamide
CAS Number:
83202-22-6
Molecular Formula:
C22H16N2O4S2
Molecular Weight:
436.5034
IUPAC Name:
N-[4-(benzenesulfonylimino)naphthalen-1-ylidene]benzenesulfonamide
InChI:
InChI=1S/C22H16N2O4S2/c25-29(26,17-9-3-1-4-10-17)23-21-15-16-22(20-14-8-7-13-19(20)21)24-30(27,28)18-11-5-2-6-12-18/h1-16H
InChI Key:
DMYWAKAZWKYTMZ-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)/N=C\1/C=C/C(=N/S(=O)(=O)c2ccccc2)/c2c1cccc2
Properties
Complexity:
835
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
436.055g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
436.5g/mol
Monoisotopic Mass:
436.055g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.3
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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