Name: methyl 5-[N-acetyl-N-(2-methoxyethyl)amino]-4,7-dihydro-4,7-dioxobenzo[b]thiophene-2-carboxylate
SMILES:
COCCN(C(C)=O)C1=CC(=O)c2sc(C(=O)OC)cc2C1=OMolecular Processing
Molecular formula
C15H15NO6S
Molecular weight
337.35
Exact mass
337.062
XLogP
1.29
TPSA
89.98
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
81.67
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→