Basic information
- CAS
91924-65-1- Standard SMILES
COc1cc(-c2nn3cc(-c4cccc5ccccc45)nc3s2)cc(OC)c1OC- InChIKey
LEKKKFWUPCOYTH-UHFFFAOYSA-N- Molecular formula
- C23H19N3O3S
- Average molar mass
- 417.5 g/mol
- Monoisotopic mass
- 417.11471265
Names & identifiers
- Preferred name
- Imidazo(2,1-b)-1,3,4-thiadiazole, 6-(naphthalenyl)-2-(3,4,5-trimethoxyphenyl)-
- IUPAC
- 6-naphthalen-1-yl-2-(3,4,5-trimethoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole
Names & synonyms
Imidazo(2,1-b)-1,3,4-thiadiazole, 6-(naphthalenyl)-2-(3,4,5-trimethoxyphenyl)-6-(Naphthalenyl)-2-(3,4,5-trimethoxyphenyl)imidazo(2,1-b)-1,3,4-thiadiazole91924-65-1DTXSID50238790RefChem:348715DTXCID001612816-(Naphthalen-1-yl)-2-(3,4,5-trimethoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazole
Database identifiers
- CAS
91924-65-1- PubChem CID
- 3045314
- DTXSID
DTXSID50238790
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 570
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…