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918343-48-3

918343-48-3 | Benzenesulfonamide, N-[2-[2-(1,1-dimethylethyl)phenoxy]-3-pyridinyl]-

CAS No: 918343-48-3 Catalog No: AG006G4F MDL No:

Product Description

Catalog Number:
AG006G4F
Chemical Name:
Benzenesulfonamide, N-[2-[2-(1,1-dimethylethyl)phenoxy]-3-pyridinyl]-
CAS Number:
918343-48-3
Molecular Formula:
C21H22N2O3S
Molecular Weight:
382.4760
IUPAC Name:
N-[2-(2-tert-butylphenoxy)pyridin-3-yl]benzenesulfonamide
InChI:
InChI=1S/C21H22N2O3S/c1-21(2,3)17-12-7-8-14-19(17)26-20-18(13-9-15-22-20)23-27(24,25)16-10-5-4-6-11-16/h4-15,23H,1-3H3
InChI Key:
WJHFHOZFXJXWMI-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)Nc1cccnc1Oc1ccccc1C(C)(C)C

Properties

Complexity:
561  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.135g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
382.478g/mol
Monoisotopic Mass:
382.135g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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