Nombre: tert-butyl ((1S,2R)-2-((6-(2,6-dichloro-3,5-dimethoxyphenyl)quinazolin-2-yl)amino)cyclohexyl)carbamate
SMILES:
COc1cc(OC)c(Cl)c(-c2ccc3nc(N[C@@H]4CCCC[C@@H]4NC(=O)OC(C)(C)C)ncc3c2)c1ClMolecular Processing
Molecular formula
C27H32Cl2N4O4
Molecular weight
547.48
Exact mass
546.1801
XLogP
6.87
TPSA
94.6
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
147.13
Supplementary Information
Obteniendo detalles…
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