الاسم: 7-[3-[[(2,3-Dihydro-7-methoxy-1,4-benzodioxin-2-yl)methyl]amino]propoxy]-2H-1-benzopyran-2-one hydrochloride
SMILES:
COc1ccc2c(c1)OC(CNCCCOc1ccc3ccc(=O)oc3c1)CO2.ClMolecular Processing
Molecular formula
C22H24ClNO6
Molecular weight
433.89
Exact mass
433.1292
XLogP
3.42
TPSA
79.16
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.318
Molar refractivity
115.62
Supplementary Information
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