Basic information
- CAS
1301689-09-7- Standard SMILES
CC(=O)Nc1ccc2n(c1)c1ccccc1[n+]2CC(=O)N1CCOCC1- InChIKey
QSNFFHPAYHYYDC-UHFFFAOYSA-O- Molecular formula
- C19H21N4O3+
- Average molar mass
- 353.4 g/mol
- Monoisotopic mass
- 353.16136554
Names & identifiers
- Preferred name
- 2-(Acetylamino)-5-[2-(4-morpholinyl)-2-oxoethyl]pyrido[2,1-b]benzimidazol-5-ium
- IUPAC
- N-[5-(2-morpholin-4-yl-2-oxoethyl)pyrido[1,2-a]benzimidazol-5-ium-2-yl]acetamide
- English name
- 2-(acetylamino)-5-[2-(4-morpholinyl)-2-oxoethyl]pyrido[2,1-b]benzimidazol-5-ium
- Molecular formula
- C19H21N4O3+
- Molecular weight
- 353.39504
Names & synonyms
2-(acetylamino)-5-[2-(4-morpholinyl)-2-oxoethyl]pyrido[2,1-b]benzimidazol-5-iumAQ-776/42801753N-[5-(2-morpholin-4-yl-2-oxoethyl)pyrido[1,2-a]benzimidazol-5-ium-2-yl]acetamide
Database identifiers
- CAS
1301689-09-7- PubChem CID
- 7312620
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 1
- Complexity
- 537
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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