CC(C)(C)C(C)(O)COc1cc(C(=O)O)nn1-c1ccccc1F
SMILES: CC(C)(C)C(C)(O)COc1cc(C(=O)O)nn1-c1ccccc1F

Molecular Processing

Molecular formula
C17H21FN2O4
Molecular weight
336.36
Exact mass
336.1485
XLogP
2.89
TPSA
84.58
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
86.06

Supplementary Information

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