SMILES:
CC1CCCN(C[C@@H]2COc3ccc(S(C)(=O)=O)cc3O2)C1Molecular Processing
Molecular formula
C16H23NO4S
Molecular weight
325.43
Exact mass
325.1348
XLogP
1.96
TPSA
55.84
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
84.3
Supplementary Information
Загрузка подробностей…
Участвует в 1 реакциях→