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3028-04-4 | Propanamide, N-2-benzothiazolyl-2-methyl- (9CI)
CAS No: 3028-04-4 Catalog No: AG00BWDR MDL No:
Product Description
Catalog Number:
AG00BWDR
Chemical Name:
Propanamide, N-2-benzothiazolyl-2-methyl- (9CI)
CAS Number:
3028-04-4
IUPAC Name:
N-(1,3-benzothiazol-2-yl)-2-methylpropanamide
InChI:
InChI=1S/C11H12N2OS/c1-7(2)10(14)13-11-12-8-5-3-4-6-9(8)15-11/h3-7H,1-2H3,(H,12,13,14)
InChI Key:
CKLZVSGUBDNFIW-UHFFFAOYSA-N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.29g/mol
Monoisotopic Mass:
220.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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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