Home Carboxys tert-butyl 4-(pyrimidin-4-yl)piperazine-1-carboxylate

tert-butyl 4-(pyrimidin-4-yl)piperazine-1-carboxylate

CAS No.:
221050-89-1
Catalog Number:
AG00BJKM
Molecular Formula:
C13H20N4O2
Molecular Weight:
264.3235
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Product Description
Catalog Number:
AG00BJKM
Chemical Name:
tert-butyl 4-(pyrimidin-4-yl)piperazine-1-carboxylate
CAS Number:
221050-89-1
Molecular Formula:
C13H20N4O2
Molecular Weight:
264.3235
MDL Number:
MFCD26383921
IUPAC Name:
tert-butyl 4-pyrimidin-4-ylpiperazine-1-carboxylate
InChI:
InChI=1S/C13H20N4O2/c1-13(2,3)19-12(18)17-8-6-16(7-9-17)11-4-5-14-10-15-11/h4-5,10H,6-9H2,1-3H3
InChI Key:
KQDGVJCIWVOYPX-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1ccncn1)OC(C)(C)C
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.159g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.329g/mol
Monoisotopic Mass:
264.159g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties