SMILES:
O=C(C1CC1)N1CCC(Cc2n[nH]c(=O)n2-c2c(F)cc(Br)cc2Cl)C1Molecular Processing
Molecular formula
C17H17BrClFN4O2
Molecular weight
443.7
Exact mass
442.0207
XLogP
2.92
TPSA
70.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
97.97
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→