200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 478081-75-3
478081-75-3 | 4,6-dimethyl-2-(4-phenylmethanesulfonylpiperazin-1-yl)pyridine-3-carbonitrile
CAS No: 478081-75-3 Catalog No: AG00ISE7 MDL No:MFCD02102786
Product Description
Catalog Number:
AG00ISE7
Chemical Name:
4,6-dimethyl-2-(4-phenylmethanesulfonylpiperazin-1-yl)pyridine-3-carbonitrile
CAS Number:
478081-75-3
Molecular Formula:
C19H22N4O2S
Molecular Weight:
370.4686
MDL Number:
MFCD02102786
IUPAC Name:
2-(4-benzylsulfonylpiperazin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
InChI:
InChI=1S/C19H22N4O2S/c1-15-12-16(2)21-19(18(15)13-20)22-8-10-23(11-9-22)26(24,25)14-17-6-4-3-5-7-17/h3-7,12H,8-11,14H2,1-2H3
InChI Key:
YYDDMYACLMMNSL-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)cc(nc1N1CCN(CC1)S(=O)(=O)Cc1ccccc1)C
Properties
Complexity:
609
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.146g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.471g/mol
Monoisotopic Mass:
370.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
85.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.