SMILES:
CC(C)c1c2n(c(=O)c3ccccc13)CCCS2Molecular Processing
Molecular formula
C15H17NOS
Molecular weight
259.37
Exact mass
259.1031
XLogP
3.62
TPSA
22
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
77.64
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→