O=C(NCc1cccs1)c1ccc(CN2C(=O)C3(COc4cc5c(cc43)CCO5)c3ccccc32)cc1
SMILES: O=C(NCc1cccs1)c1ccc(CN2C(=O)C3(COc4cc5c(cc43)CCO5)c3ccccc32)cc1

Molecular Processing

Molecular formula
C30H24N2O4S
Molecular weight
508.6
Exact mass
508.1457
XLogP
4.84
TPSA
67.87
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
37
Rings
7
Aromatic rings
4
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
141.48

Supplementary Information

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