SMILES:
Cc1[nH]c(C=C2C(=O)Nc3ccc(Br)cc32)c(C)c1CCCN1CCOCC1Molecular Processing
Molecular formula
C22H26BrN3O2
Molecular weight
444.37
Exact mass
443.1208
XLogP
4.15
TPSA
57.36
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
116.49
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→