GW-678248
Basic information
- CAS
329939-64-2- Standard SMILES
Cc1cc(S(N)(=O)=O)ccc1NC(=O)COc1ccc(Cl)cc1C(=O)c1cc(Cl)cc(C#N)c1- InChIKey
BTOMIMSUTLPSHA-UHFFFAOYSA-N- Molecular formula
- C23H17Cl2N3O5S
- Average molar mass
- 518.4 g/mol
- Monoisotopic mass
- 517.0265972
Overview
inhibits wild-type HIV reverse transcriptase; structure in first source
Names & identifiers
- Preferred name
- GW-678248
- IUPAC
- 2-[4-chloro-2-(3-chloro-5-cyanobenzoyl)phenoxy]-N-(2-methyl-4-sulfamoylphenyl)acetamide
- English name
- GW678248
- Molecular formula
- C23H17Cl2N3O5S
- Molecular weight
- 518.37
Names & synonyms
329939-64-2GW-8248GW678248GW-678248GW8248C932C98SNYGW248GW-8248XGSK678248DTXSID00333148Gw 678248RefChem:201128
Show more names
CS-326GW 8248XGW8248,GW 8248Acetamide, N-[4-(aminosulfonyl)-2-methylphenyl]-2-[4-chloro-2-(3-chloro-5-cyanobenzoyl)phenoxy]-
DTXCID102842382-[4-chloro-2-(3-chloro-5-cyanobenzoyl)phenoxy]-N-(2-methyl-4-sulfamoylphenyl)acetamide2-{4-chloro-2-[(3-chloro-5-cyanophenyl)carbonyl]phenoxy}-N-(2-methyl-4-sulfamoylphenyl)acetamideUNII-C932C98SNYCHEMBL2034202-(4-Chloro-2-(3-chloro-5-cyano-benzoyl)phenoxy)-N-(2-methyl-4-sulfamoyl-phenyl)acetamideAcetamide, N-(4-(aminosulfonyl)-2-methylphenyl)-2-(4-chloro-2-(3-chloro-5-cyanobenzoyl)phenoxy)-2-[4-chloro-2-(3-chloro-5-cyano-benzoyl)phenoxy]-N-(2-methyl-4-sulfamoyl-phenyl)acetamide
Database identifiers
- CAS
329939-64-2- PubChem CID
- 486532
- DTXSID
DTXSID00333148- ChEMBL
CHEMBL203420- UNII
- C932C98SNY
- Nikkaji
- J2.103.873C
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 902
Physicochemical properties
- Density
- 1.54 · 1.54±0.1 g/cm3(Predicted)
- pka
- 9.96 · 9.96±0.60(Predicted)
- FDA UNII
- 932 C98SNY · C932C98SNY
- Comptox DTXSID
- 333148 · DTXSID00333148
Chemistry & industry
Applications
UsesGW-678248 is an active compound.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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