COC(=O)c1ccc2[nH]c(=S)n(Cc3ccccc3)c(=O)c2c1
SMILES: COC(=O)c1ccc2[nH]c(=S)n(Cc3ccccc3)c(=O)c2c1

Molecular Processing

Molecular formula
C17H14N2O3S
Molecular weight
326.38
Exact mass
326.0725
XLogP
2.89
TPSA
64.09
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
90.28

Supplementary Information

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