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Home > Pyridines > 565166-70-3
565166-70-3 | 4-methoxy-3-{[2-(pyridin-2-yl)ethyl]sulfamoyl}benzoic acid
CAS No: 565166-70-3 Catalog No: AG019GOM MDL No:MFCD03966914
Product Description
Catalog Number:
AG019GOM
Chemical Name:
4-methoxy-3-{[2-(pyridin-2-yl)ethyl]sulfamoyl}benzoic acid
CAS Number:
565166-70-3
Molecular Formula:
C15H16N2O5S
Molecular Weight:
336.3629
MDL Number:
MFCD03966914
IUPAC Name:
4-methoxy-3-(2-pyridin-2-ylethylsulfamoyl)benzoic acid
InChI:
InChI=1S/C15H16N2O5S/c1-22-13-6-5-11(15(18)19)10-14(13)23(20,21)17-9-7-12-4-2-3-8-16-12/h2-6,8,10,17H,7,9H2,1H3,(H,18,19)
InChI Key:
GUNHNFJLHHGFNP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)NCCc1ccccn1)C(=O)O
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.078g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
336.362g/mol
Monoisotopic Mass:
336.078g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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