Name: tert-butyl 5-(6-(2-chloroethoxy)-7-methoxy-2-(3-(2-morpholinoacetamido)phenyl)quinazolin-4-ylamino)-1H-indazole-1-carboxylate
SMILES:
COc1cc2nc(-c3cccc(NC(=O)CN4CCOCC4)c3)nc(Nc3ccc4c(cnn4C(=O)OC(C)(C)C)c3)c2cc1OCCClMolecular Processing
Molecular formula
C35H38ClN7O6
Molecular weight
688.18
Exact mass
687.2572
XLogP
6.07
TPSA
141.96
H-bond donors
2
H-bond acceptors
11
Rotatable bonds
10
Heavy atoms
49
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.343
Molar refractivity
188.28
Supplementary Information
Details werden geladen…
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