Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCOC(=O)C[C@H](NC(=O)CCCCc1ccc2c(n1)NCCC2)c1cnc2ccccc2c1- InChIKey
XDLDYKSQRRNBJI-DEOSSOPVSA-N- Molecular formula
- C27H32N4O3
- Average molar mass
- 460.6 g/mol
- Monoisotopic mass
- 460.2474409
Names & identifiers
- Preferred name
- Ethyl 3-(5-(5,6,7,8-tetrahydro-[1,8]-naphthyridin-2-yl)pentanoylamino)-3(S)-(quinolin-3-yl)-propionate
- IUPAC
- ethyl (3S)-3-quinolin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoate
Names & synonyms
SCHEMBL6423205XDLDYKSQRRNBJI-DEOSSOPVSA-NEthyl 3-(5-(5,6,7,8-tetrahydro-[1,8]-naphthyridin-2-yl)pentanoylamino)-3(S)-(quinolin-3-yl)-propionate
Database identifiers
- PubChem CID
- 60105751
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 93.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 660
Related reactions
8 records
Compound notes
Loading…