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606082-97-7 | Benzenesulfonamide, 4-[[4-(2-benzothiazolyl)-1-piperidinyl]sulfonyl]-N,N-diethyl- (9CI)
CAS No: 606082-97-7 Catalog No: AG00ENWK MDL No:
Product Description
Catalog Number:
AG00ENWK
Chemical Name:
Benzenesulfonamide, 4-[[4-(2-benzothiazolyl)-1-piperidinyl]sulfonyl]-N,N-diethyl- (9CI)
CAS Number:
606082-97-7
IUPAC Name:
4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-N,N-diethylbenzenesulfonamide
InChI:
InChI=1S/C22H27N3O4S3/c1-3-24(4-2)31(26,27)18-9-11-19(12-10-18)32(28,29)25-15-13-17(14-16-25)22-23-20-7-5-6-8-21(20)30-22/h5-12,17H,3-4,13-16H2,1-2H3
InChI Key:
DFUNREQWDOYTTA-UHFFFAOYSA-N
Properties
Complexity:
820
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
493.116g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
493.655g/mol
Monoisotopic Mass:
493.116g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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