이름: 4-(4-bromo-2,6-difluoroanilino)-7-hydroxy-6-methoxyquinazoline
SMILES:
COc1cc2c(Nc3c(F)cc(Br)cc3F)ncnc2cc1OMolecular Processing
Molecular formula
C15H10BrF2N3O2
Molecular weight
382.16
Exact mass
380.9924
XLogP
4.13
TPSA
67.27
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
85.1
Supplementary Information
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