trivial
25B-NBF
systemic
2-(4-bromo-2,5-dimethoxyphenyl)-N-[(2-fluorophenyl)methyl]ethanamine
2-(4-Bromo-2,5-dimethoxyphenyl)-'N'-(2-fluorobenzyl)ethanamine
25B-NBF
systemic
2-(4-bromo-2,5-dimethoxyphenyl)-N-[(2-fluorophenyl)methyl]ethanamine
2-(4-Bromo-2,5-dimethoxyphenyl)-'N'-(2-fluorobenzyl)ethanamine
Identifiers
InChIKey: ATMBBMXJNIJRST-UHFFFAOYSA-N
Formula: C17H19BrFNO2
CAS Registry numbers:
1539266-17-5
Descriptors
Bioavailability-related
Molecular weight: 367.06 DaPartition coefficient: 3.94
H bond donors: 1
H bond acceptors: 3
Rotatable bonds: 7
Molar refractivity: 89.06 J mol-1 K-1
Polar surface area: 30.49 Å2
Generic
Stereocenters: 0Heteroatoms: 5
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 2Heterocycles: 0
Aromatic rings: 2
Aromatic carbocycles: 2
Aromatic heterocycles: 0
Aliphatic rings: 0
Aliphatic carbocycles: 0
Aliphatic heterocycles: 0