7,7-dimethyl-10-(2-thienyl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dione
Basic information
- CAS
5804-28-4- Standard SMILES
CC1(C)CC(=O)C2=C(C1)N=C1c3ccccc3C(=O)C1C2c1cccs1- InChIKey
OUAGFBJNDYEIMS-UHFFFAOYSA-N- Molecular formula
- C22H19NO2S
- Average molar mass
- 361.5 g/mol
- Monoisotopic mass
- 361.11365002
Names & identifiers
- Preferred name
- 7,7-dimethyl-10-(2-thienyl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dione
- IUPAC
- 7,7-dimethyl-10-thiophen-2-yl-6,8,10,10a-tetrahydroindeno[1,2-b]quinoline-9,11-dione
Names & synonyms
7,7-dimethyl-10-(2-thienyl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dione5804-28-47,7-dimethyl-10-(thiophen-2-yl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dioneAC1MFCXDCBMicro_034114ChemDiv1_023618Cambridge id 5804284HMS654B12DTXSID70386707STK021983AKOS000620007AKOS022078686
Show more names
7,7-dimethyl-10-thiophen-2-yl-6,8,10,10a-tetrahydroindeno[1,2-b]quinoline-9,11-dioneBIM-0034181.P001EU-0041859AG-690/12892680SR-01000465566SR-01000465566-1
Database identifiers
- CAS
5804-28-4- PubChem CID
- 2869730
- DTXSID
DTXSID70386707
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 74.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 734
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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