1,2-bis(1H-indol-3-yl)ethane-1,2-dione
Basic information
- CAS
65610-87-9- Standard SMILES
O=C(C(=O)c1c[nH]c2ccccc12)c1c[nH]c2ccccc12- InChIKey
VOUJHLROTVTYMT-UHFFFAOYSA-N- Molecular formula
- C18H12N2O2
- Average molar mass
- 288.3 g/mol
- Monoisotopic mass
- 288.08987763
Overview
1,2-Bis(1H-indol-3-yl)ethane-1,2-dione has been reported in Fusarium with data available.
Names & identifiers
- Preferred name
- 1,2-bis(1H-indol-3-yl)ethane-1,2-dione
- IUPAC
- 1,2-bis(1H-indol-3-yl)ethane-1,2-dione
Names & synonyms
1,2-Bis(1H-indol-3-yl)ethane-1,2-dione65610-87-9DTXSID30348386RefChem:71696DTXCID60299458CHEMBL3339208Di-indol-3-yl-ethanedione1,2-bis(3-indolyl)glyoxalSCHEMBL4954977BDBM50029019Di(1H-indol-3-yl)ethane-1,2-dione1,2-di-1H-indol-3-ylethane-1,2-dione
Show more names
1,2-ethanedione, 1,2-di-1H-indol-3-yl-1,2-bis(1H-indol-3-yl)-ethane-1,2-dione1,2-Bis-(1H-indol-3-yl)-ethane-1,2-dioneInChI=1/C18H12N2O2/c21-17(13-9-19-15-7-3-1-5-11(13)15)18(22)14-10-20-16-8-4-2-6-12(14)16/h1-10,19-20
Database identifiers
- CAS
65610-87-9- PubChem CID
- 636743
- DTXSID
DTXSID30348386- ChEMBL
CHEMBL3339208- Nikkaji
- J1.741.977C
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 422
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…