SMILES:
CCOC(=O)C1CSCCN1C(=O)Nc1ccc(Cl)cc1FMolecular Processing
Molecular formula
C14H16ClFN2O3S
Molecular weight
346.81
Exact mass
346.0554
XLogP
2.99
TPSA
58.64
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
84.88
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→