2-(4-benzyl-piperidin-1-sulfonyl)-1H-indol-6-ol
Basic information
- CAS
933474-41-0- Standard SMILES
O=S(=O)(c1cc2ccc(O)cc2[nH]1)N1CCC(Cc2ccccc2)CC1- InChIKey
HUBHJLIWBSUNSW-UHFFFAOYSA-N- Molecular formula
- C20H22N2O3S
- Average molar mass
- 370.5 g/mol
- Monoisotopic mass
- 370.13511374
Names & identifiers
- Preferred name
- 2-(4-benzyl-piperidin-1-sulfonyl)-1H-indol-6-ol
- IUPAC
- 2-(4-benzylpiperidin-1-yl)sulfonyl-1H-indol-6-ol
Names & synonyms
CHEMBL2207862-(4-benzyl-piperidin-1-sulfonyl)-1H-indol-6-olDTXSID201191709BDBM50204903933474-41-02-(4-Benzylpiperidine-1-sulfonyl)-1H-indol-6-ol2-[[4-(Phenylmethyl)-1-piperidinyl]sulfonyl]-1H-indol-6-ol
Database identifiers
- CAS
933474-41-0- PubChem CID
- 16110232
- DTXSID
DTXSID201191709- ChEMBL
CHEMBL220786
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 562
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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