tert-Butyl-4-(2-(5-(2-Chloropheny)-4-chloro-2-methoxyphenylamino)acetyl)piperazine-1-carboxylate
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Basic information
- Standard SMILES
COc1cc(Cl)c(-c2ccccc2Cl)cc1NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1- InChIKey
XWPDEDBNXGGPKN-UHFFFAOYSA-N- Molecular formula
- C24H29Cl2N3O4
- Average molar mass
- 494.4 g/mol
Names & identifiers
- Preferred name
- tert-Butyl-4-(2-(5-(2-Chloropheny)-4-chloro-2-methoxyphenylamino)acetyl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 4-[2-[4-chloro-5-(2-chlorophenyl)-2-methoxyanilino]acetyl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL16102324XWPDEDBNXGGPKN-UHFFFAOYSA-Ntert-Butyl-4-(2-(5-(2-Chloropheny)-4-chloro-2-methoxyphenylamino)acetyl)piperazine-1-carboxylatetert-Butyl-4-(2-(5-(2-Chlorophenyl)-4-chloro-2-methoxyphenylamino)acetyl)piperazine-1-carboxylate
Database identifiers
- PubChem CID
- 90462596
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 667
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Related reactions
2 records
Compound notes
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