(2S)-2-acetamido-6-[[allyl(nitroso)carbamoyl]amino]-N-benzyl-hexanamide
Basic information
- Standard SMILES
C=CCN(N=O)C(=O)NCCCC[C@H](NC(C)=O)C(=O)NCc1ccccc1- InChIKey
NYJRGGMIIZJDLE-KRWDZBQOSA-N- Molecular formula
- C19H27N5O4
- Average molar mass
- 389.4 g/mol
- Monoisotopic mass
- 389.20630436
Names & identifiers
- Preferred name
- (2S)-2-acetamido-6-[[allyl(nitroso)carbamoyl]amino]-N-benzyl-hexanamide
- IUPAC
- (2S)-2-acetamido-N-benzyl-6-[[nitroso(prop-2-enyl)carbamoyl]amino]hexanamide
Names & synonyms
MCS-681DTXSID401026166N2-Acetyl-N6-[allyl(nitroso)carbamoyl]-N-benzyllysinamide(2S)-2-acetamido-6-[[allyl(nitroso)carbamoyl]amino]-N-benzyl-hexanamideN-Benzyl-N^2-acetyl-N^6-[(N-nitrosoallylamino)carbonyl]-L-lysinamide
Database identifiers
- PubChem CID
- 460430
- DTXSID
DTXSID401026166
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 534
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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