Name: 3,5-Dimethyl-4-pyrimidin-2-ylpiperazine-1-carboxylic acid tert-butyl ester
SMILES:
CC1CN(C(=O)OC(C)(C)C)CC(C)N1c1ncccn1Molecular Processing
Molecular formula
C15H24N4O2
Molecular weight
292.38
Exact mass
292.1899
XLogP
2.31
TPSA
58.56
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
81.24
Supplementary Information
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