Nom: tert-butyl 5-(2-(3-(2-methoxyacetamido)phenyl)quinazolin-4-ylamino)-1H-indazole-1-carboxylate
SMILES:
COCC(=O)Nc1cccc(-c2nc(Nc3ccc4c(cnn4C(=O)OC(C)(C)C)c3)c3ccccc3n2)c1Molecular Processing
Molecular formula
C29H28N6O4
Molecular weight
524.58
Exact mass
524.2172
XLogP
5.76
TPSA
120.26
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
39
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.207
Molar refractivity
150.13
Supplementary Information
Récupération des détails…
Impliqué dans 3 réactions→