Name: tert-Butyl 2-(5-chloro-6-phenylpyridin-3-ylamino)-5-methylbenzoate
SMILES:
Cc1ccc(Nc2cnc(-c3ccccc3)c(Cl)c2)c(C(=O)OC(C)(C)C)c1Molecular Processing
Molecular formula
C23H23ClN2O2
Molecular weight
394.9
Exact mass
394.1448
XLogP
6.41
TPSA
51.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
114.31
Supplementary Information
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