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959696-44-7 | 6-(4-isopropylpiperazin-1-yl)pyrimidin-4-amine
CAS No: 959696-44-7 Catalog No: AG01FMMR MDL No:MFCD20485776
Product Description
Catalog Number:
AG01FMMR
Chemical Name:
6-(4-isopropylpiperazin-1-yl)pyrimidin-4-amine
CAS Number:
959696-44-7
Molecular Formula:
C11H19N5
Molecular Weight:
221.3021
MDL Number:
MFCD20485776
IUPAC Name:
6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
InChI:
InChI=1S/C11H19N5/c1-9(2)15-3-5-16(6-4-15)11-7-10(12)13-8-14-11/h7-9H,3-6H2,1-2H3,(H2,12,13,14)
InChI Key:
DJNNGYLUBQVWSA-UHFFFAOYSA-N
SMILES:
CC(N1CCN(CC1)c1ncnc(c1)N)C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.164g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.308g/mol
Monoisotopic Mass:
221.164g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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