SMILES:
CC(NC(=O)OC(C)(C)C)c1ccc(-c2cccnc2Cl)cc1Molecular Processing
Molecular formula
C18H21ClN2O2
Molecular weight
332.83
Exact mass
332.1292
XLogP
4.99
TPSA
51.22
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
92.47
Supplementary Information
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