Acridine, 9,9'-tetramethylenediiminobis-
Basic information
- CAS
58478-33-4- Standard SMILES
c1ccc2c(NCCCCNc3c4ccccc4nc4ccccc34)c3ccccc3nc2c1- InChIKey
MKFRLGCMWOIRSO-UHFFFAOYSA-N- Molecular formula
- C30H26N4
- Average molar mass
- 442.6 g/mol
- Monoisotopic mass
- 442.21574685
Names & identifiers
- Preferred name
- Acridine, 9,9'-tetramethylenediiminobis-
- IUPAC
- N,N'-di(acridin-9-yl)butane-1,4-diamine
Names & synonyms
ACRIDINE, 9,9'-TETRAMETHYLENEDIIMINOBIS-58478-33-4Bis(9-acridinyl)-putrescine9,9'-TetramethylenediiminodiacridineBRN 0363640N,N'-Di(9-acridinyl)-1,4-diaminobutaneN,N'-di(acridin-9-yl)butane-1,4-diamine1,4-Butanediamine, N,N'-bis(9-acridinyl)-NSC2197324-21-00-04185 (Beilstein Handbook Reference)CHEMBL38642SCHEMBL5578493
Show more names
DTXSID50207168NSC 219732NSC-219732WLN: T C666 BNJ IM4M- IT C666 BNJN~1~,N~4~-Di(acridin-9-yl)butane-1,4-diamineXA5
Database identifiers
- CAS
58478-33-4- PubChem CID
- 42755
- DTXSID
DTXSID50207168- ChEMBL
CHEMBL38642- Nikkaji
- J66.944J
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 541
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Compound notes
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