SMILES:
CSc1cc(Cl)cc(C)c1C(=O)NC(c1ccccc1)C1(N(C)C)CCCC1Molecular Processing
Molecular formula
C23H29ClN2OS
Molecular weight
417.02
Exact mass
416.1689
XLogP
5.72
TPSA
32.34
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
119.51
Supplementary Information
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