이름: 3,5-dimethyl-2-[4-[4-(2-hydroxyethoxy)benzoyl]benzylthio]-4(3H)-quinazolinone
SMILES:
Cc1cccc2nc(SCc3ccc(C(=O)c4ccc(OCCO)cc4)cc3)n(C)c(=O)c12Molecular Processing
Molecular formula
C26H24N2O4S
Molecular weight
460.56
Exact mass
460.1457
XLogP
4.14
TPSA
81.42
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
130.18
Supplementary Information
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