Isoleucyl-phenylalanyl-lysine chloromethyl ketone
Basic information
- CAS
126642-86-2- Standard SMILES
CCC(C)C(N)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCCN)C(=O)CCl- InChIKey
KSIKYWAXFUJAAE-CAIZAGQASA-N- Molecular formula
- C22H35ClN4O3
- Average molar mass
- 439 g/mol
- Monoisotopic mass
- 438.2397687
Overview
RN given is for cpd with L-Ile
Names & identifiers
- Preferred name
- Isoleucyl-phenylalanyl-lysine chloromethyl ketone
- IUPAC
- 2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide
- English name
- isoleucyl-phenylalanyl-lysine chloromethyl ketone
- Molecular formula
- C22H35ClN4O3
- Molecular weight
- 438.99
Names & synonyms
Ile-phe-lys-CH2ClIsoleucyl-phenylalanyl-lysine chloromethyl ketone126642-86-2RefChem:149478DTXSID80925641L-Phenylalaninamide, L-isoleucyl-N-(5-amino-1-(chloroacetyl)pentyl)-, (S)-2-Amino-N-{1-[(7-amino-1-chloro-2-oxoheptan-3-yl)imino]-1-hydroxy-3-phenylpropan-2-yl}-3-methylpentanimidic acidL-Phenylalaninamide, L-isoleucyl-N-[5-amino-1-(chloroacetyl)pentyl]-, (S)- (9CI)
Database identifiers
- CAS
126642-86-2- PubChem CID
- 124393
- DTXSID
DTXSID80925641
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 14
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 540
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…