trivial
MDMB-FUBINACA
systemic
2-[[1-[(4-fluorophenyl) methyl] indazole-3-carbonyl] amino]-3,3-dimethyl-butanoate
Methyl (2'S')-2-{[1-[(4-fluorophenyl)methyl]indazole-3-carbonyl]amino}-3,3-dimethylbutanoate

Identifiers

InChIKey: RFCDVEHNYDVCMU-LJQANCHMSA-N

Formula: C22H24FN3O3

CAS Registry numbers:
1715016-77-5

Descriptors

Bioavailability-related

Molecular weight: 397.18 Da
Partition coefficient: 3.54
H bond donors: 1
H bond acceptors: 6
Rotatable bonds: 8
Molar refractivity: 107.96 J mol-1 K-1
Polar surface area: 73.22 Å2

Generic

Stereocenters: 1
Heteroatoms: 7
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 1

Ring-related

Rings: 3
Heterocycles: 1
Aromatic rings: 3
Aromatic carbocycles: 2
Aromatic heterocycles: 1
Aliphatic rings: 0
Aliphatic carbocycles: 0
Aliphatic heterocycles: 0