trivial
Dichloropane
RTI-111
systemic
methyl 3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Methyl (1'R',2'S',3'S',5'S')-3-(3,4-dichlorophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
Dichloropane
RTI-111
systemic
methyl 3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Methyl (1'R',2'S',3'S',5'S')-3-(3,4-dichlorophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
Identifiers
InChIKey: AMIHUYQKNJHXPT-DRABBMOASA-N
Formula: C16H19Cl2NO2
CAS Registry numbers:
146725-34-0
Descriptors
Bioavailability-related
Molecular weight: 327.08 DaPartition coefficient: 3.73
H bond donors: 0
H bond acceptors: 3
Rotatable bonds: 3
Molar refractivity: 83.90 J mol-1 K-1
Polar surface area: 29.54 Å2
Generic
Stereocenters: 4Heteroatoms: 5
Spiroatoms: 0
Bridge atoms: 2
Amide bonds: 0
Ring-related
Rings: 3Heterocycles: 2
Aromatic rings: 1
Aromatic carbocycles: 1
Aromatic heterocycles: 0
Aliphatic rings: 2
Aliphatic carbocycles: 0
Aliphatic heterocycles: 2