GW-5634 free acid
Basic information
- CAS
855122-98-4- Standard SMILES
CCC(=O)NS(=O)(=O)c1ccc(NC(=O)COc2ccccc2C(=O)c2cc(Cl)cc(C#N)c2)c(C)c1- InChIKey
HFZFOZBELSHLFI-UHFFFAOYSA-N- Molecular formula
- C26H22ClN3O6S
- Average molar mass
- 540 g/mol
- Monoisotopic mass
- 539.0917843
Names & identifiers
- Preferred name
- GW-5634 free acid
- IUPAC
- N-[4-[[2-[2-(3-chloro-5-cyanobenzoyl)phenoxy]acetyl]amino]-3-methylphenyl]sulfonylpropanamide
Names & synonyms
GW-5634 free acidUNII-O6O9X95338O6O9X95338855122-98-4Propanamide, N-((4-(((2-(3-chloro-5-cyanobenzoyl)phenoxy)acetyl)amino)-3-methylphenyl)sulfonyl)-Propanamide, N-((4-((2-(2-(3-chloro-5-cyanobenzoyl)phenoxy)acetyl)amino)-3-methylphenyl)sulfonyl)-GW5634 (*Sodium salt*)GW5634 (Prodrug of GW8248)Q27285411N-[4-[[2-[2-(3-chloro-5-cyano-benzoyl)phenoxy]acetyl]amino]-3-methyl-phenyl]sulfonylpropanamidePropanamide, N-[[4-[[2-[2-(3-chloro-5-cyanobenzoyl)phenoxy]acetyl]amino]-3-methylphenyl]sulfonyl]-, ion(1-)
Database identifiers
- CAS
855122-98-4- PubChem CID
- 470255
- UNII
- O6O9X95338
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 990
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…