Basic information
- CAS
15451-93-1- Standard SMILES
CCOc1ccc(Nc2nc3cc(C(C)=O)ccc3n2CCN(CC)CC)cc1- InChIKey
AFRHRAQAEFGOEN-UHFFFAOYSA-N- Molecular formula
- C23H30N4O2
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.23687621
Names & identifiers
- Preferred name
- Ketone, 1-(2-(diethylamino)ethyl)-2-p-phenetidino-5-benzimidazolyl methyl
- IUPAC
- 1-[1-[2-(diethylamino)ethyl]-2-(4-ethoxyanilino)benzimidazol-5-yl]ethanone
Names & synonyms
BRN 0722676KETONE, 1-(2-(DIETHYLAMINO)ETHYL)-2-p-PHENETIDINO-5-BENZIMIDAZOLYL METHYL15451-93-1DTXSID501656531-(2-(Diethylamino)ethyl)-2-p-phenetidino-5-benzimidazolyl methyl ketone5-25-15-00125 (Beilstein Handbook Reference)RefChem:350371DTXCID30881441-{1-[2-(Diethylamino)ethyl]-2-(4-ethoxyanilino)-1H-1,3-benzimidazol-5-yl}ethan-1-one
Database identifiers
- CAS
15451-93-1- PubChem CID
- 27293
- DTXSID
DTXSID50165653
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 505
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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