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Home > Pyridines > 338773-33-4
338773-33-4 | 4-methoxy-2-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile
CAS No: 338773-33-4 Catalog No: AG00IOUM MDL No:MFCD00975443
Product Description
Catalog Number:
AG00IOUM
Chemical Name:
4-methoxy-2-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile
CAS Number:
338773-33-4
Molecular Formula:
C17H18N4O
Molecular Weight:
294.3510
MDL Number:
MFCD00975443
IUPAC Name:
4-methoxy-2-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C17H18N4O/c1-22-16-7-8-19-17(15(16)13-18)21-11-9-20(10-12-21)14-5-3-2-4-6-14/h2-8H,9-12H2,1H3
InChI Key:
CVDPZJYJZIAFSJ-UHFFFAOYSA-N
SMILES:
N#Cc1c(OC)ccnc1N1CCN(CC1)c1ccccc1
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.148g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.358g/mol
Monoisotopic Mass:
294.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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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