trivial
PTI-2
systemic
'N'-(2-methoxyethyl)-'N'-((2-(1-pentyl-1'H'-indol-3-yl)thiazol-4-yl)methyl)propan-2-amine
PTI-2
systemic
'N'-(2-methoxyethyl)-'N'-((2-(1-pentyl-1'H'-indol-3-yl)thiazol-4-yl)methyl)propan-2-amine
Identifiers
InChIKey: PSAKYYVEVVAWJL-UHFFFAOYSA-N
Formula: C23H33N3OS
CAS Registry numbers:
1400742-45-1
Descriptors
Bioavailability-related
Molecular weight: 399.23 DaPartition coefficient: 5.81
H bond donors: 0
H bond acceptors: 4
Rotatable bonds: 11
Molar refractivity: 119.99 J mol-1 K-1
Polar surface area: 30.29 Å2
Generic
Stereocenters: 0Heteroatoms: 5
Spiroatoms: 0
Bridge atoms: 0
Amide bonds: 0
Ring-related
Rings: 3Heterocycles: 2
Aromatic rings: 3
Aromatic carbocycles: 1
Aromatic heterocycles: 2
Aliphatic rings: 0
Aliphatic carbocycles: 0
Aliphatic heterocycles: 0