SMILES:
CC(C)c1nc(COC(=O)Oc2ccc([N+](=O)[O-])cc2)cs1Molecular Processing
Molecular formula
C14H14N2O5S
Molecular weight
322.34
Exact mass
322.0623
XLogP
3.89
TPSA
91.56
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
80.11
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 18 تفاعل→