Acridine, 1,2,3,4-tetrahydro-7-chloro-9-(3-(diethylamino)propylamino)-, dihydrochloride
Basic information
- CAS
5393-97-5- Standard SMILES
CC[NH+](CC)CCC[NH2+]c1c2c(nc3ccc(Cl)cc13)CCCC2.[Cl-].[Cl-]- InChIKey
VYDJRAHQPKXMDP-UHFFFAOYSA-N- Molecular formula
- C20H30Cl3N3
- Average molar mass
- 418.8 g/mol
- Monoisotopic mass
- 417.150531
Names & identifiers
- Preferred name
- Acridine, 1,2,3,4-tetrahydro-7-chloro-9-(3-(diethylamino)propylamino)-, dihydrochloride
- IUPAC
- 3-[(7-chloro-1,2,3,4-tetrahydroacridin-9-yl)azaniumyl]propyl-diethylazanium dichloride
Names & synonyms
NSC 2461Acridine, 1,2,3,4-tetrahydro-7-chloro-9-(3-(diethylamino)propylamino)-, dihydrochloride1,3-Propanediamine, N'-(7-chloro-1,2,3,4-tetrahydro-9-acridinyl)-N,N-diethyl-, dihydrochloride7-Chloro-9-(3-(diethylamino)propylamino)-1,2,3,4-tetrahydroacridine dihydrochloride5393-97-5RefChem:3170461,3-Propanediamine, N'-(7-chloro-1,2,3,4-tetrahydro-9-acridinyl)-N,N-diethyl-, dihydrochloride (9CI)
Database identifiers
- CAS
5393-97-5- PubChem CID
- 21489
Properties
Computed structural properties
- Topological polar surface area
- 33.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 374
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Compound notes
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