الاسم: Intermediate 27
SMILES:
CC(C)(C)OC(=O)NCCNc1cccc2cnccc12Molecular Processing
Molecular formula
C16H21N3O2
Molecular weight
287.36
Exact mass
287.1634
XLogP
3.17
TPSA
63.25
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
84.47
Supplementary Information
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