Carbazoquinocin C
PubChem CID: 10335508
Connections displayed (default: 10).
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| Compound Synonyms | Carbazoquinocin C, 1-heptyl-2-methyl-9H-carbazole-3,4-dione, SCHEMBL13424600, CHEMBL4740609, CHEBI:219848 |
|---|---|
| Topological Polar Surface Area | 49.9 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 23.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 508.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-heptyl-2-methyl-9H-carbazole-3,4-dione |
| Prediction Hob | 1.0 |
| Xlogp | 5.1 |
| Molecular Formula | C20H23NO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | XFGOIZUEQXLEAH-UHFFFAOYSA-N |
| Fcsp3 | 0.4 |
| Logs | -3.785 |
| Rotatable Bond Count | 6.0 |
| Logd | 3.95 |
| Compound Name | Carbazoquinocin C |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 309.173 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 309.173 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 309.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.852301017391304 |
| Inchi | InChI=1S/C20H23NO2/c1-3-4-5-6-7-10-14-13(2)19(22)20(23)17-15-11-8-9-12-16(15)21-18(14)17/h8-9,11-12,21H,3-7,10H2,1-2H3 |
| Smiles | CCCCCCCC1=C(C(=O)C(=O)C2=C1NC3=CC=CC=C32)C |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Leontice Smirnowii (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Swertia Perennis (Plant) Rel Props:Source_db:cmaup_ingredients