trivial
25I-NBMD
systemic
2-(4-iodo-2,5-dimethoxyphenyl)-N-[(2,3-methylenedioxyphenyl)methyl]ethanamine
'N'-[(2'H'-1,3-benzodioxol-4-yl)methyl]-2-(4-iodo-2,5-dimethoxyphenyl)ethan-1-amine
25I-NBMD
systemic
2-(4-iodo-2,5-dimethoxyphenyl)-N-[(2,3-methylenedioxyphenyl)methyl]ethanamine
'N'-[(2'H'-1,3-benzodioxol-4-yl)methyl]-2-(4-iodo-2,5-dimethoxyphenyl)ethan-1-amine
Identifiers
InChIKey: NJNMIPDEUMTYNV-UHFFFAOYSA-N
Formula: C18H20INO4
CAS Registry numbers:
919797-25-4
Descriptors
Bioavailability-related
Molecular weight: 441.04 DaPartition coefficient: 3.37
H bond donors: 1
H bond acceptors: 5
Rotatable bonds: 7
Molar refractivity: 100.24 J mol-1 K-1
Polar surface area: 48.95 Å2
Generic
Stereocenters: 0Heteroatoms: 6
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 3Heterocycles: 1
Aromatic rings: 2
Aromatic carbocycles: 2
Aromatic heterocycles: 0
Aliphatic rings: 1
Aliphatic carbocycles: 0
Aliphatic heterocycles: 1