4-Acridinecarboxamide, 9-amino-N-(2-((2-hydroxyethyl)amino)ethyl)-
Basic information
- CAS
89459-30-3- Standard SMILES
Nc1c2ccccc2nc2c(C(=O)NCCNCCO)cccc12- InChIKey
LGDNJXAZBBKQQZ-UHFFFAOYSA-N- Molecular formula
- C18H20N4O2
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.15862589
Names & identifiers
- Preferred name
- 4-Acridinecarboxamide, 9-amino-N-(2-((2-hydroxyethyl)amino)ethyl)-
- IUPAC
- 9-amino-N-[2-(2-hydroxyethylamino)ethyl]acridine-4-carboxamide
- English name
- 9-Amino-N-(2-((2-hydroxyethyl)amino)ethyl)-4-acridinecarboxamide
- Molecular formula
- C18H20N4O2
- Molecular weight
- 324.38
Names & synonyms
89459-30-34-Acridinecarboxamide, 9-amino-N-(2-((2-hydroxyethyl)amino)ethyl)-9-Amino-N-(2-((2-hydroxyethyl)amino)ethyl)acridine-4-carboxamide9-AMINO-N-{2-[(2-HYDROXYETHYL)AMINO]ETHYL}ACRIDINE-4-CARBOXAMIDE9-Amino-N-(2-((2-hydroxyethyl)amino)ethyl)-4-acridinecarboxamideCHEMBL35055DTXSID702377404-Acridinecarboxamide, 9-amino-N-[2-[(2-hydroxyethyl)amino]ethyl]-
Database identifiers
- CAS
89459-30-3- PubChem CID
- 150236
- DTXSID
DTXSID70237740- ChEMBL
CHEMBL35055- Nikkaji
- J978.619H
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 420
Physicochemical properties
- Boiling point
- 708 · 708.0±55.0 °C(Predicted)
- Density
- 1.3 · 1.300±0.06 g/cm3(Predicted)
- pka
- 13.39 · 13.39±0.46(Predicted)
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Compound notes
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