Name: 1-difluoromethyl-7-iodo-1-methyl-1,2,3,4-tetrahydro-benzofuro[2,3-C]pyridine
SMILES:
CC1(C(F)F)NCCc2c1oc1cc(I)ccc21Molecular Processing
Molecular formula
C13H12F2INO
Molecular weight
363.15
Exact mass
362.9932
XLogP
3.66
TPSA
25.17
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
73.99
Supplementary Information
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