Home Other Building Blocks 2-[4-(4-Bromobutyl)-1-piperazinyl]pyrimidine

2-[4-(4-Bromobutyl)-1-piperazinyl]pyrimidine

CAS No.:
87789-48-8
Catalog Number:
AG01D8SQ
Molecular Formula:
C12H19BrN4
Molecular Weight:
299.2101
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Product Description
Catalog Number:
AG01D8SQ
Chemical Name:
2-[4-(4-Bromobutyl)-1-piperazinyl]pyrimidine
CAS Number:
87789-48-8
Molecular Formula:
C12H19BrN4
Molecular Weight:
299.2101
MDL Number:
MFCD00436566
IUPAC Name:
2-[4-(4-bromobutyl)piperazin-1-yl]pyrimidine
InChI:
InChI=1S/C12H19BrN4/c13-4-1-2-7-16-8-10-17(11-9-16)12-14-5-3-6-15-12/h3,5-6H,1-2,4,7-11H2
InChI Key:
PSBMPSNKIDFXIK-UHFFFAOYSA-N
SMILES:
BrCCCCN1CCN(CC1)c1ncccn1
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.079g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.216g/mol
Monoisotopic Mass:
298.079g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties