이름: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-1,3-propanediamine
SMILES:
CN(CCCN)Cc1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C12H18N2O2
Molecular weight
222.29
Exact mass
222.1368
XLogP
1.2
TPSA
47.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
62.57
Supplementary Information
No supplementary data available
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