Name: [(1-chloro-4-hydroxy-6,7-diphenoxy-isoquinoline-3-carbonyl)-amino]-acetic acid
SMILES:
O=C(O)CNC(=O)c1nc(Cl)c2cc(Oc3ccccc3)c(Oc3ccccc3)cc2c1OMolecular Processing
Molecular formula
C24H17ClN2O6
Molecular weight
464.86
Exact mass
464.0775
XLogP
4.99
TPSA
117.98
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.042
Molar refractivity
121.42
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→