Basic information
- Standard SMILES
NC(=O)C[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(N)Cc1ccccc1- InChIKey
JZJUDUJPFVHZHP-KCHLEUMXSA-N- Molecular formula
- C31H34N6O4
- Average molar mass
- 554.6 g/mol
Names & identifiers
- Preferred name
- 1-[2(S)-Hydroxy-3(S)-(N-(quinoline-2-carbonyl)-(L)-asparaginyl)amino-4-phenylbutyl]-1-[phenylmethyl]-hydrazine
- IUPAC
- (2S)-N-[(2S,3S)-4-[amino(benzyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide
Names & synonyms
SCHEMBL6444504JZJUDUJPFVHZHP-KCHLEUMXSA-N1-[2(S)-hydroxy-3(S)-(N-(quinoline-2-carbonyl)-(L)-asparaginyl)amino-4-phenyl-butyl]-1-[phenylmethyl]-hydrazine1-[2(S)-Hydroxy-3(S)-(N-(quinoline-2-carbonyl)-(L)-asparaginyl)amino-4-phenylbutyl]-1-[phenylmethyl]-hydrazine
Database identifiers
- PubChem CID
- 69782895
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 846
Related reactions
2 records
Compound notes
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