L-Alanyl-N-{4-[(6-methoxyquinolin-8-yl)amino]pentyl}-L-leucinamide
Basic information
- CAS
76542-77-3- Standard SMILES
COc1cc(NC(C)CCCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)c2ncccc2c1- InChIKey
UDHPXWMPQDXDDU-WURXZWLQSA-N- Molecular formula
- C24H37N5O3
- Average molar mass
- 443.6 g/mol
- Monoisotopic mass
- 443.28964006
Names & identifiers
- Preferred name
- L-Alanyl-N-{4-[(6-methoxyquinolin-8-yl)amino]pentyl}-L-leucinamide
- IUPAC
- (2S)-2-[[(2S)-2-aminopropanoyl]amino]-N-[4-[(6-methoxyquinolin-8-yl)amino]pentyl]-4-methylpentanamide
Names & synonyms
76542-77-3DTXSID40822824L-Alanyl-N-{4-[(6-methoxyquinolin-8-yl)amino]pentyl}-L-leucinamide
Database identifiers
- CAS
76542-77-3- PubChem CID
- 71401807
- DTXSID
DTXSID40822824
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 588
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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