SMILES:
CCOC(=O)[C@H](Cc1ccc(-c2c(OC)cc(CN3CCSCC3)cc2OC)cc1)NC(=O)c1c(Cl)cccc1ClMolecular Processing
Molecular formula
C31H34Cl2N2O5S
Molecular weight
617.6
Exact mass
616.1565
XLogP
6.13
TPSA
77.1
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
41
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.355
Molar refractivity
165.64
Supplementary Information
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Involved in 2 reactions→