Benzamide, N,Na(2)-(5,10,15,16,17,22,23,24-octahydro-5,10,15,17,22,24-hexaoxonaphth[2a(2),3a(2):6,7]indolo[2,3-c]dinaphtho[2,3-a:2a(2),3a(2)-i]carbazole-4,11-diyl)bis-
Basic information
- CAS
84559-86-4- Standard SMILES
O=C(Nc1cccc2c(=O)c3c(ccc4c3[nH]c3c5c(=O)c6ccccc6c(=O)c5c5[nH]c6c(ccc7c(=O)c8c(NC(=O)c9ccccc9)cccc8c(=O)c76)c5c43)c(=O)c12)c1ccccc1- InChIKey
OCSQWNPKXCIEFK-UHFFFAOYSA-N- Molecular formula
- C56H28N4O8
- Average molar mass
- 884.8 g/mol
- Monoisotopic mass
- 884.19071386
Names & identifiers
- Preferred name
- Benzamide, N,Na(2)-(5,10,15,16,17,22,23,24-octahydro-5,10,15,17,22,24-hexaoxonaphth[2a(2),3a(2):6,7]indolo[2,3-c]dinaphtho[2,3-a:2a(2),3a(2)-i]carbazole-4,11-diyl)bis-
- IUPAC
- N-(38-benzamido-7,14,20,27,33,40-hexaoxo-17,30-diazaundecacyclo[27.15.0.02,18.03,16.06,15.08,13.019,28.021,26.031,44.032,41.034,39]tetratetraconta-1,3(16),4,6(15),8(13),9,11,18,21,23,25,28,31(44),32(41),34(39),35,37,42-octadecaen-9-yl)benzamide
Names & synonyms
DTXSID401100146Benzamide, N,Na(2)-(5,10,15,16,17,22,23,24-octahydro-5,10,15,17,22,24-hexaoxonaphth[2a(2),3a(2):6,7]indolo[2,3-c]dinaphtho[2,3-a:2a(2),3a(2)-i]carbazole-4,11-diyl)bis-
Database identifiers
- CAS
84559-86-4- PubChem CID
- 165366376
- DTXSID
DTXSID401100146
Properties
Computed structural properties
- XLogP
- 10.5
- Topological polar surface area
- 192 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 68
- Formal charge
- 0
- Complexity
- 2,000
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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