名称: 7-bromo-6-methylthioquinazolin-4(3H)-one formic acid salt
SMILES:
CSc1cc2c(=O)[nH]cnc2cc1Br.O=COMolecular Processing
Molecular formula
C10H9BrN2O3S
Molecular weight
317.16
Exact mass
315.9517
XLogP
2.11
TPSA
83.05
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.1
Molar refractivity
70.54
Supplementary Information
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