Basic information
- Standard SMILES
CCNC(=O)NN(C)CC(=O)N[C@@H](C)C(=O)N(Cc1cccc2cccnc12)[C@@H](C)C(OCC)OCC- InChIKey
LYSUYSIXWDTXBJ-OALUTQOASA-N- Molecular formula
- C26H40N6O5
- Average molar mass
- 516.6 g/mol
Names & identifiers
- Preferred name
- 1-(2-((S)-1-(((S)-1,1-diethoxypropan-2-yl)(quinolin-8-ylmethyl)amino)-1-oxopropan-2-ylamino)-2-oxoethyl)-4-ethyl-1-methylsemicarbazide
- IUPAC
- (2S)-N-[(2S)-1,1-diethoxypropan-2-yl]-2-[[2-[(ethylcarbamoylamino)-methylamino]acetyl]amino]-N-(quinolin-8-ylmethyl)propanamide
Names & synonyms
SCHEMBL1557500LYSUYSIXWDTXBJ-OALUTQOASA-N1-(2-((S)-1-(((S)-1,1-diethoxypropan-2-yl)(quinolin-8-ylmethyl)amino)-1-oxopropan-2-ylamino)-2-oxoethyl)-4-ethyl-1-methylsemicarbazide
Database identifiers
- PubChem CID
- 67075282
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 14
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 720
Related reactions
2 records
Compound notes
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