Basic information
- CAS
50332-27-9- Standard SMILES
O=C(c1cccs1)n1c2c(c3cc4c(cc31)OCO4)CCCC2- InChIKey
YZVRSLDSWQBCBD-UHFFFAOYSA-N- Molecular formula
- C18H15NO3S
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.07726451
Names & identifiers
- Preferred name
- 5H-1,3-Dioxolo(4,5-b)carbazole, 6,7,8,9-tetrahydro-5-(2-thenoyl)-
- IUPAC
- 5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-b]carbazol-9-yl(thiophen-2-yl)methanone
- English name
- 6,7,8,9-Tetrahydro-5-(2-thenoyl)-5H-1,3-dioxolo[4,5-b]carbazole
- Molecular formula
- C18H15NO3S
- Molecular weight
- 325.38
Names & synonyms
50332-27-95H-1,3-DIOXOLO(4,5-b)CARBAZOLE, 6,7,8,9-TETRAHYDRO-5-(2-THENOYL)-DTXSID201983725-(2-Thenoyl)-6,7,8,9-tetrahydro-5H-1,3-dioxolo(4,5-b)carbazole5H-1,3-Dioxolo(4,5-b)carbazole, 6,7,8,9-tetrahydro-5-(2-thienylcarbonyl)-RefChem:305225DTXCID501208636,7,8,9-Tetrahydro-5-(2-thenoyl)-5H-1,3-dioxolo[4,5-b]carbazoleDB-242697(6,7,8,9-Tetrahydro-2H,5H-[1,3]dioxolo[4,5-b]carbazol-5-yl)(thiophen-2-yl)methanone5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-b]carbazol-9-yl(thiophen-2-yl)methanoneMethanone, (6,7,8,9-tetrahydro-5H-1,3-dioxolo[4,5-b]carbazol-5-yl)-2-thienyl-
Database identifiers
- CAS
50332-27-9- PubChem CID
- 39629
- DTXSID
DTXSID20198372- Nikkaji
- J83.725C
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 68.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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