Nom: N4-(4-(2-methoxyethoxy)-2-nitrophenyl)-N6-methylpyrimidine-4,6-diamine
SMILES:
CNc1cc(Nc2ccc(OCCOC)cc2[N+](=O)[O-])ncn1Molecular Processing
Molecular formula
C14H17N5O4
Molecular weight
319.32
Exact mass
319.1281
XLogP
2.2
TPSA
111.44
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
85.33
Supplementary Information
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