이름: Intermediate 20
SMILES:
CC(C)(C)OC(=O)NCCCOc1cccc2c(N)nccc12Molecular Processing
Molecular formula
C17H23N3O3
Molecular weight
317.39
Exact mass
317.1739
XLogP
3.11
TPSA
86.47
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
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
90.5
Supplementary Information
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