名称: 6-chloro-7-methylthioquinazolin-4(3H)-one
SMILES:
CSc1cc2nc[nH]c(=O)c2cc1ClMolecular Processing
Molecular formula
C9H7ClN2OS
Molecular weight
226.69
Exact mass
225.9968
XLogP
2.3
TPSA
45.75
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
59.15
Supplementary Information
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