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478077-79-1 | N'-(4-methoxybenzenesulfonyl)-1-(6-methylpyridin-2-yl)-1H-imidazole-4-carbohydrazide
CAS No: 478077-79-1 Catalog No: AG00IRXT MDL No:MFCD01871692
Product Description
Catalog Number:
AG00IRXT
Chemical Name:
N'-(4-methoxybenzenesulfonyl)-1-(6-methylpyridin-2-yl)-1H-imidazole-4-carbohydrazide
CAS Number:
478077-79-1
Molecular Formula:
C17H17N5O4S
Molecular Weight:
387.4130
MDL Number:
MFCD01871692
IUPAC Name:
N'-(4-methoxyphenyl)sulfonyl-1-(6-methylpyridin-2-yl)imidazole-4-carbohydrazide
InChI:
InChI=1S/C17H17N5O4S/c1-12-4-3-5-16(19-12)22-10-15(18-11-22)17(23)20-21-27(24,25)14-8-6-13(26-2)7-9-14/h3-11,21H,1-2H3,(H,20,23)
InChI Key:
RLLCIKZRVKRYBK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)NNC(=O)c1ncn(c1)c1cccc(n1)C
Properties
Complexity:
603
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
387.1g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
387.414g/mol
Monoisotopic Mass:
387.1g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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