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174728-03-1 | Pyrimidine, 2-chloro-4-(1-piperazinyl)-
CAS No: 174728-03-1 Catalog No: AG001ZWV MDL No:
Product Description
Catalog Number:
AG001ZWV
Chemical Name:
Pyrimidine, 2-chloro-4-(1-piperazinyl)-
CAS Number:
174728-03-1
Molecular Formula:
C8H11ClN4
Molecular Weight:
198.6527
IUPAC Name:
2-chloro-4-piperazin-1-ylpyrimidine
InChI:
InChI=1S/C8H11ClN4/c9-8-11-2-1-7(12-8)13-5-3-10-4-6-13/h1-2,10H,3-6H2
InChI Key:
SFYYCOYORWAGQC-UHFFFAOYSA-N
SMILES:
Clc1nccc(n1)N1CCNCC1
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.654g/mol
Monoisotopic Mass:
198.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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