Home Other Building Blocks Ethyl 5-cyano-6-methyl-2-(piperazin-1-yl)nicotinate

Ethyl 5-cyano-6-methyl-2-(piperazin-1-yl)nicotinate

CAS No.:
402479-97-4
Catalog Number:
AG00C877
Molecular Formula:
C14H18N4O2
Molecular Weight:
274.3183
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
1 week
United States
$170
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Product Description
Catalog Number:
AG00C877
Chemical Name:
Ethyl 5-cyano-6-methyl-2-(piperazin-1-yl)nicotinate
CAS Number:
402479-97-4
Molecular Formula:
C14H18N4O2
Molecular Weight:
274.3183
MDL Number:
MFCD01311995
IUPAC Name:
ethyl 5-cyano-6-methyl-2-piperazin-1-ylpyridine-3-carboxylate
InChI:
InChI=1S/C14H18N4O2/c1-3-20-14(19)12-8-11(9-15)10(2)17-13(12)18-6-4-16-5-7-18/h8,16H,3-7H2,1-2H3
InChI Key:
GJWLMJKBRLNVMS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(C#N)c(nc1N1CCNCC1)C
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.143g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.324g/mol
Monoisotopic Mass:
274.143g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties