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433688-20-1

433688-20-1 | 4-IODO-N-(2-MORPHOLIN-4-YL-ETHYL)-BENZENESULFONAMIDE

CAS No: 433688-20-1 Catalog No: AG00DC5Y MDL No:

Product Description

Catalog Number:
AG00DC5Y
Chemical Name:
4-IODO-N-(2-MORPHOLIN-4-YL-ETHYL)-BENZENESULFONAMIDE
CAS Number:
433688-20-1
IUPAC Name:
4-iodo-N-(2-morpholin-4-ylethyl)benzenesulfonamide
InChI:
InChI=1S/C12H17IN2O3S/c13-11-1-3-12(4-2-11)19(16,17)14-5-6-15-7-9-18-10-8-15/h1-4,14H,5-10H2
InChI Key:
GIRAKQBBPBYUBM-UHFFFAOYSA-N

Properties

Complexity:
358  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
396.243g/mol
Monoisotopic Mass:
396g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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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