Basic information
- Standard SMILES
O=S(=O)(c1ccccc1)n1ncc2c(-c3ncc(CO)o3)cc(Cl)cc21- InChIKey
KEEISJGHQXBDBB-UHFFFAOYSA-N- Molecular formula
- C17H12ClN3O4S
- Average molar mass
- 389.8 g/mol
- Monoisotopic mass
- 389.0237047
Names & identifiers
- Preferred name
- 2-[6-chloro-1-(phenylsulfonyl)-1H-indazol-4-yl]-5-Oxazolemethanol
- IUPAC
- [2-[1-(benzenesulfonyl)-6-chloroindazol-4-yl]-1,3-oxazol-5-yl]methanol
Names & synonyms
1254036-83-3[2-[1-(benzenesulfonyl)-6-chloroindazol-4-yl]-1,3-oxazol-5-yl]methanol{2-[1-(benzenesulfonyl)-6-chloro-1H-indazol-4-yl]-1,3-oxazol-5-yl}methanol2-[6-chloro-1-(phenylsulfonyl)-1H-indazol-4-yl]-5-OxazolemethanolSCHEMBL110755KEEISJGHQXBDBB-UHFFFAOYSA-N(2-(6-chloro-1-(phenylsulfonyl)-1H-indazol-4-yl)oxazol-5-yl)methanolDB-260586
Database identifiers
- PubChem CID
- 59564706
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 595
Related reactions
10 records
Compound notes
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