A-(dichloroacetyl)phenylalaninamide
Basic information
- CAS
1462-80-2- Standard SMILES
O=C(NC(Cc1ccccc1)C(=O)N(CCCl)CCCl)C(Cl)Cl- InChIKey
OVZZKGPJKBADNJ-UHFFFAOYSA-N- Molecular formula
- C15H18Cl4N2O2
- Average molar mass
- 400.1 g/mol
- Monoisotopic mass
- 398.012239
Names & identifiers
- Preferred name
- A-(dichloroacetyl)phenylalaninamide
- IUPAC
- N,N-bis(2-chloroethyl)-2-[(2,2-dichloroacetyl)amino]-3-phenylpropanamide
Names & synonyms
1462-80-2NSC65672N,N-Dimethyl-L-Tyrosinen,n-bis(2-chloroethyl)-nDTXSID20289936A-(dichloroacetyl)phenylalaninamideNSC-65672N,N-bis(2-chloroethyl)-Nalpha-(dichloroacetyl)phenylalaninamide
Database identifiers
- CAS
1462-80-2- PubChem CID
- 248495
- DTXSID
DTXSID20289936
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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