O=c1c2ccccc2nc(-c2ccccc2)n1CCCl
Name: 3-(2-chloroethyl)-2-phenyl-4(3H)-quinazolinone
SMILES: O=c1c2ccccc2nc(-c2ccccc2)n1CCCl

Molecular Processing

Molecular formula
C16H13ClN2O
Molecular weight
284.75
Exact mass
284.0716
XLogP
3.3
TPSA
34.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
82.16

Supplementary Information

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