N-(5-((4-((9,10-Dihydro-9,10-dioxo-1-anthryl)amino)-6-phenoxy-1,3,5-triazin-2-yl)amino)-9,10-dihydro-9,10-dioxo-1-anthryl)benzamide
Basic information
- CAS
83949-92-2- Standard SMILES
O=C(Nc1cccc2c1C(=O)c1cccc(Nc3nc(Nc4cccc5c4C(=O)c4ccccc4C5=O)nc(Oc4ccccc4)n3)c1C2=O)c1ccccc1- InChIKey
HODFFUYCJXEUAG-UHFFFAOYSA-N- Molecular formula
- C44H26N6O6
- Average molar mass
- 734.7 g/mol
- Monoisotopic mass
- 734.19138257
Overview
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Names & identifiers
- Preferred name
- N-(5-((4-((9,10-Dihydro-9,10-dioxo-1-anthryl)amino)-6-phenoxy-1,3,5-triazin-2-yl)amino)-9,10-dihydro-9,10-dioxo-1-anthryl)benzamide
- IUPAC
- N-[5-[[4-[(9,10-dioxoanthracen-1-yl)amino]-6-phenoxy-1,3,5-triazin-2-yl]amino]-9,10-dioxoanthracen-1-yl]benzamide
Names & synonyms
83949-92-2EINECS 281-449-1N-(5-((4-((9,10-Dihydro-9,10-dioxo-1-anthryl)amino)-6-phenoxy-1,3,5-triazin-2-yl)amino)-9,10-dihydro-9,10-dioxo-1-anthryl)benzamideNS00061802
Database identifiers
- CAS
83949-92-2- PubChem CID
- 11970751
- EC Number
- 281-449-1
- Nikkaji
- J296.290J
Properties
Computed structural properties
- XLogP
- 10
- Topological polar surface area
- 169 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 8
- Heavy atoms
- 56
- Formal charge
- 0
- Complexity
- 1,480
Related reactions
0 records
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Compound notes
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