CC(C)N1CCC(COCC(NC(=O)c2cc3ccc(Cl)cc3s2)c2ccccc2Cl)CC1
SMILES: CC(C)N1CCC(COCC(NC(=O)c2cc3ccc(Cl)cc3s2)c2ccccc2Cl)CC1

Molecular Processing

Molecular formula
C26H30Cl2N2O2S
Molecular weight
505.51
Exact mass
504.1405
XLogP
6.82
TPSA
41.57
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
138.75

Supplementary Information

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