Name: alcohol
SMILES:
CCc1nn(CCO)c(CC)c1Oc1cc(C#N)cc(OC)c1Molecular Processing
Molecular formula
C17H21N3O3
Molecular weight
315.37
Exact mass
315.1583
XLogP
2.67
TPSA
80.3
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
85.85
Supplementary Information
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Involved in 3 reactions→