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1153251-03-6

1153251-03-6 | 1-(1H-pyrazole-4-carbonyl)-4-(pyridin-2-yl)piperazine

CAS No: 1153251-03-6 Catalog No: AG019TQY MDL No:MFCD12744474

Product Description

Catalog Number:
AG019TQY
Chemical Name:
1-(1H-pyrazole-4-carbonyl)-4-(pyridin-2-yl)piperazine
CAS Number:
1153251-03-6
Molecular Formula:
C13H15N5O
Molecular Weight:
257.2911
MDL Number:
MFCD12744474
IUPAC Name:
1H-pyrazol-4-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
InChI:
InChI=1S/C13H15N5O/c19-13(11-9-15-16-10-11)18-7-5-17(6-8-18)12-3-1-2-4-14-12/h1-4,9-10H,5-8H2,(H,15,16)
InChI Key:
VCOHZTSMODNTJH-UHFFFAOYSA-N
SMILES:
O=C(c1cn[nH]c1)N1CCN(CC1)c1ccccn1

Properties

Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.128g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.297g/mol
Monoisotopic Mass:
257.128g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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