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Home > Sulfanilamide > 6326-06-3
6326-06-3 | 4-Methyl-N-(9H-xanthen-9-yl)-benzenesulfonamide
CAS No: 6326-06-3 Catalog No: AG01EA5X MDL No:
Product Description
Catalog Number:
AG01EA5X
Chemical Name:
4-Methyl-N-(9H-xanthen-9-yl)-benzenesulfonamide
CAS Number:
6326-06-3
Molecular Formula:
C20H17NO3S
Molecular Weight:
351.4189
IUPAC Name:
4-methyl-N-(9H-xanthen-9-yl)benzenesulfonamide
InChI:
InChI=1S/C20H17NO3S/c1-14-10-12-15(13-11-14)25(22,23)21-20-16-6-2-4-8-18(16)24-19-9-5-3-7-17(19)20/h2-13,20-21H,1H3
InChI Key:
OZCQEUZTOAAWDK-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NC1c2ccccc2Oc2c1cccc2
NSC Number:
31171
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.093g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.42g/mol
Monoisotopic Mass:
351.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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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