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1212132-25-6 | 4-(4,6-Dimethyl-pyrimidin-2-ylamino)-cyclohexanol
CAS No: 1212132-25-6 Catalog No: AG01F972 MDL No:
Product Description
Catalog Number:
AG01F972
Chemical Name:
4-(4,6-Dimethyl-pyrimidin-2-ylamino)-cyclohexanol
CAS Number:
1212132-25-6
Molecular Formula:
C12H19N3O
Molecular Weight:
221.2988
IUPAC Name:
4-[(4,6-dimethylpyrimidin-2-yl)amino]cyclohexan-1-ol
InChI:
InChI=1S/C12H19N3O/c1-8-7-9(2)14-12(13-8)15-10-3-5-11(16)6-4-10/h7,10-11,16H,3-6H2,1-2H3,(H,13,14,15)
InChI Key:
KACDOSDSGXJVEC-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@H](CC1)Nc1nc(C)cc(n1)C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.153g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.304g/mol
Monoisotopic Mass:
221.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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