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604761-88-8 | Benzenesulfonamide, 4-[(4-formyl-1-piperazinyl)sulfonyl]-N,N-dimethyl- (9CI)
CAS No: 604761-88-8 Catalog No: AG00EO1O MDL No:
Product Description
Catalog Number:
AG00EO1O
Chemical Name:
Benzenesulfonamide, 4-[(4-formyl-1-piperazinyl)sulfonyl]-N,N-dimethyl- (9CI)
CAS Number:
604761-88-8
IUPAC Name:
4-(4-formylpiperazin-1-yl)sulfonyl-N,N-dimethylbenzenesulfonamide
InChI:
InChI=1S/C13H19N3O5S2/c1-14(2)22(18,19)12-3-5-13(6-4-12)23(20,21)16-9-7-15(11-17)8-10-16/h3-6,11H,7-10H2,1-2H3
InChI Key:
UHXPMMNGAJVHGT-UHFFFAOYSA-N
Properties
Complexity:
605
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.077g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.431g/mol
Monoisotopic Mass:
361.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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