Basic information
- Standard SMILES
COC(=O)c1ccc(N)cc1NC(=O)c1ccc(C(C)(C)C)cc1- InChIKey
KLUZMVGUXCGCCC-UHFFFAOYSA-N- Molecular formula
- C19H22N2O3
- Average molar mass
- 326.4 g/mol
Names & identifiers
- Preferred name
- 4-Amino-2-(4-tert-butyl-benzoylamino)-benzoic acid methyl ester
- IUPAC
- methyl 4-amino-2-[(4-tert-butylbenzoyl)amino]benzoate
Names & synonyms
SCHEMBL4801219KLUZMVGUXCGCCC-UHFFFAOYSA-N4-amino-2- (4-tert-butyl-benzoylamino)-benzoic acid methyl ester4-amino-2-(4-tert-butyl-benzoylamino)-benzoic acid methyl ester
Database identifiers
- PubChem CID
- 69196671
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 450
Related reactions
6 records
Compound notes
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