SMILES:
CC(=NNC(=S)Nc1ccc(C(=O)O)cc1)c1nn(Cc2ccccc2)c(-c2ccc(C(C)(C)C)cc2)c1OMolecular Processing
Molecular formula
C30H31N5O3S
Molecular weight
541.68
Exact mass
541.2148
XLogP
6.01
TPSA
111.77
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
39
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
0.2
Molar refractivity
158.54
Supplementary Information
Obteniendo detalles…
Participa en 3 reacciones→