SMILES:
CC(C)(C)c1nc2cc(N3CCOCC3)c([N+](=O)[O-])cc2s1Molecular Processing
Molecular formula
C15H19N3O3S
Molecular weight
321.4
Exact mass
321.1147
XLogP
3.34
TPSA
68.5
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
88.01
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→