Basic information
- Standard SMILES
COc1ccc(CN(c2ncns2)S(=O)(=O)c2cc3oc(=O)n([C@H](C)c4cccc(Br)c4)c3cc2F)c(OC)c1- InChIKey
GCSYLRLLFJHDFY-OAHLLOKOSA-N- Molecular formula
- C26H22BrFN4O6S2
- Average molar mass
- 649.5 g/mol
Names & identifiers
- Preferred name
- (R)-3-(1-(3-Bromophenyl)ethyl)-N-(2,4-dimethoxybenzyl)-5-fluoro-2-oxo-N-(1,2,4-thiadiazol-5-yl)-2,3-dihydrobenzo[d]oxazole-6-sulfonamide
- IUPAC
- 3-[(1R)-1-(3-bromophenyl)ethyl]-N-[(2,4-dimethoxyphenyl)methyl]-5-fluoro-2-oxo-N-(1,2,4-thiadiazol-5-yl)-1,3-benzoxazole-6-sulfonamide
Names & synonyms
SCHEMBL14904862GCSYLRLLFJHDFY-OAHLLOKOSA-N(R)-3-(1-(3-Bromophenyl)ethyl)-N-(2,4-dimethoxybenzyl)-5-fluoro-2-oxo-N-(1,2,4-thiadiazol-5-yl)-2,3-dihydrobenzo[d]oxazole-6-sulfonamide
Database identifiers
- PubChem CID
- 89533765
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 9
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 995
Related reactions
1 records
Compound notes
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