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Home > Pyridines > 303147-02-6
303147-02-6 | 5-acetyl-6-methyl-2-(4-methylpiperazin-1-yl)pyridine-3-carbonitrile
CAS No: 303147-02-6 Catalog No: AG00IPKI MDL No:MFCD00793593
Product Description
Catalog Number:
AG00IPKI
Chemical Name:
5-acetyl-6-methyl-2-(4-methylpiperazin-1-yl)pyridine-3-carbonitrile
CAS Number:
303147-02-6
Molecular Formula:
C14H18N4O
Molecular Weight:
258.3189
MDL Number:
MFCD00793593
IUPAC Name:
5-acetyl-6-methyl-2-(4-methylpiperazin-1-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C14H18N4O/c1-10-13(11(2)19)8-12(9-15)14(16-10)18-6-4-17(3)5-7-18/h8H,4-7H2,1-3H3
InChI Key:
NXDRPAJWVZJSDN-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C(=O)C)c(nc1N1CCN(CC1)C)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.148g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.325g/mol
Monoisotopic Mass:
258.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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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