N-[3-(Benzenesulfonyl)-5-chloro-1H-indol-2-yl]-N'-(2-fluorophenyl)urea
Basic information
- CAS
918493-25-1- Standard SMILES
O=C(Nc1ccccc1F)Nc1[nH]c2ccc(Cl)cc2c1S(=O)(=O)c1ccccc1- InChIKey
OUPBQJVIPQYNMY-UHFFFAOYSA-N- Molecular formula
- C21H15ClFN3O3S
- Average molar mass
- 443.9 g/mol
- Monoisotopic mass
- 443.0506684
Names & identifiers
- Preferred name
- N-[3-(Benzenesulfonyl)-5-chloro-1H-indol-2-yl]-N'-(2-fluorophenyl)urea
- IUPAC
- 1-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-3-(2-fluorophenyl)urea
Names & synonyms
918493-25-1SCHEMBL3477240DTXSID60582175N-[3-(Benzenesulfonyl)-5-chloro-1H-indol-2-yl]-N'-(2-fluorophenyl)urea
Database identifiers
- CAS
918493-25-1- PubChem CID
- 16092124
- DTXSID
DTXSID60582175
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 713
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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