1,4-Butanediamine, N,N'-bis(3-(dipyrido(1,2-a:3',2'-d)imidazol-2-ylamino)propyl)-
Basic information
- CAS
98105-11-4- Standard SMILES
c1ccn2c(c1)nc1ccc(NCCCNCCCCNCCCNc3ccc4nc5ccccn5c4n3)nc12- InChIKey
AXNIQALNQNVIPK-UHFFFAOYSA-N- Molecular formula
- C30H36N10
- Average molar mass
- 536.7 g/mol
- Monoisotopic mass
- 536.31244119
Names & identifiers
- Preferred name
- 1,4-Butanediamine, N,N'-bis(3-(dipyrido(1,2-a:3',2'-d)imidazol-2-ylamino)propyl)-
- IUPAC
- N,N'-bis[3-(1,3,8-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,10,12-hexaen-4-ylamino)propyl]butane-1,4-diamine
Names & synonyms
1,4-Butanediamine, N,N'-bis(3-(dipyrido(1,2-a:3',2'-d)imidazol-2-ylamino)propyl)-98105-11-4DTXSID70243447N,N'-Bis(3-(dipyrido(1,2-a:3',2'-d)imidazol-2-ylamino)propyl)-1,4-butanediamineN~1~,N~4~-Bis{3-[(imidazo[1,2-a:5,4-b']dipyridin-2-yl)amino]propyl}butane-1,4-diamine
Database identifiers
- CAS
98105-11-4- PubChem CID
- 150480
- DTXSID
DTXSID70243447
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 681
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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