9-(2H-1,3-benzodioxol-5-yl)-9-azatricyclo[9.4.0.0²,⁷]pentadeca-1(11),2(7),3,5,12,14-hexaene-8,10-dione
Structure Info
- Chemspace ID
- CSSB00121645227 (In-Stock Building Blocks)
- MFCD
- MFCD02953586
- IUPAC Name
- 9-(2H-1,3-benzodioxol-5-yl)-9-azatricyclo[9.4.0.0²,⁷]pentadeca-1(11),2(7),3,5,12,14-hexaene-8,10-dione
- Mol formula
- C21H13NO4
- Mol weight
- 343 Da
- Catalog Number(s)
- 7453632, AA01LHZX, AG01LI2P, AN-979/40712297, BA82617, CSC121645227, F0555-0105, JH883921, OSSK_705625, ST01LJJH, STK223794, TX01LJ8D
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.85
- Heavy atoms count
- 26
- Rotatable bond count
- 1
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.047
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
![Chemical structure of 9-(2H-1,3-benzodioxol-5-yl)-9-azatricyclo[9.4.0.0²,⁷]pentadeca-1(11),2(7),3,5,12,14-hexaene-8,10-dione (C21H13NO4) - CSSB00121645227](/st/structure/200/e045e65e2afc704d05612e7abcbc7ef3/O%253DC1N%2528C2%253DCC%253DC3OCOC3%253DC2%2529C%2528%253DO%2529C2%253DC%2528C%253DCC%253DC2%2529C2%253DC1C%253DCC%253DC2.png "C21H13NO4")
- Zoom the structure
- CSSB00121645227
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 245.30 | |
Description: 9-(2H-1,3-benzodioxol-5-yl)-9-azatricyclo[9.4.0.0^{2,7}]pentadeca-1(11),2(7),3,5,12,14-hexaene-8,10-dione; CAS: 496913-57-6 | ||||||
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