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Home > Pyridines > 721916-06-9
721916-06-9 | 3-methyl-1-phenyl-6-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide
CAS No: 721916-06-9 Catalog No: AG019HRS MDL No:MFCD03956408
Product Description
Catalog Number:
AG019HRS
Chemical Name:
3-methyl-1-phenyl-6-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide
CAS Number:
721916-06-9
Molecular Formula:
C18H15N5OS
Molecular Weight:
349.4096
MDL Number:
MFCD03956408
IUPAC Name:
3-methyl-1-phenyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carbohydrazide
InChI:
InChI=1S/C18H15N5OS/c1-11-16-13(18(24)21-19)10-14(15-8-5-9-25-15)20-17(16)23(22-11)12-6-3-2-4-7-12/h2-10H,19H2,1H3,(H,21,24)
InChI Key:
CXCDZHIYBLZXCO-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cc(nc2c1c(C)nn2c1ccccc1)c1cccs1
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.1g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
349.412g/mol
Monoisotopic Mass:
349.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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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