Name: 6-(5-nitropyridin-2-yloxy)-2-phenylchroman-4-ylamine hydrochloride
SMILES:
Cl.NC1CC(c2ccccc2)Oc2ccc(Oc3ccc([N+](=O)[O-])cn3)cc21Molecular Processing
Molecular formula
C20H18ClN3O4
Molecular weight
399.83
Exact mass
399.0986
XLogP
4.73
TPSA
100.51
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.15
Molar refractivity
106.01
Supplementary Information
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