COc1ccc2c(Cl)nc(C)nc2c1
Name: 4-chloro-7-methoxy-2-methylquinazoline
SMILES: COc1ccc2c(Cl)nc(C)nc2c1

Molecular Processing

Molecular formula
C10H9ClN2O
Molecular weight
208.65
Exact mass
208.0403
XLogP
2.6
TPSA
35.01
H-bond donors
0
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
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
55.84

Supplementary Information

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