3-Carbamoyl-2-[(4-chlorophenyl)formamido]propanoic acid
Basic information
- CAS
1396965-11-9- Standard SMILES
NC(=O)CC(NC(=O)c1ccc(Cl)cc1)C(=O)O- InChIKey
KGNNVUXXSWNUIE-UHFFFAOYSA-N- Molecular formula
- C11H11ClN2O4
- Average molar mass
- 270.67 g/mol
- Monoisotopic mass
- 270.0407345
Names & identifiers
- Preferred name
- 3-Carbamoyl-2-[(4-chlorophenyl)formamido]propanoic acid
- IUPAC
- 4-amino-2-[(4-chlorobenzoyl)amino]-4-oxobutanoic acid
Names & synonyms
3-carbamoyl-2-[(4-chlorophenyl)formamido]propanoic acid1396965-11-94-amino-2-[(4-chlorobenzoyl)amino]-4-oxobutanoic acid2-(4-Chloro-benzoylamino)-succinamic acidOprea1_876470AKOS000122593AKOS017268867ST51042696EN300-04376Z859008713-carbamoyl-2-[(4-chlorophenyl)formamido]propanoicacid4-amino-2-[(4-chlorobenzoyl)amino]-4-oxo-butanoic acid
Show more names
3-carbamoyl-2-[(4-chlorophenyl)carbonylamino]propanoic acid
Database identifiers
- CAS
1396965-11-9- PubChem CID
- 3790293
- EC Number
- 194-360-7
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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