Nom: 6-(2-bromopropionyl)-3,4-dihydro-3-methyl-2(1H)-quinazolinone
SMILES:
CC(Br)C(=O)c1ccc2c(c1)CN(C)C(=O)N2Molecular Processing
Molecular formula
C12H13BrN2O2
Molecular weight
297.15
Exact mass
296.016
XLogP
2.63
TPSA
49.41
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
69.65
Supplementary Information
Récupération des détails…
Impliqué dans 4 réactions→