1-(4-Acetylamino-5-chloro-2-methoxyphenyl)-5-chloropentan-1-one

HCID 19081861

Basic information

Standard SMILES
COc1cc(NC(C)=O)c(Cl)cc1C(=O)CCCCCl
InChIKey
NYCQPCOQNLYKQC-UHFFFAOYSA-N
Molecular formula
C14H17Cl2NO3
Average molar mass
318.2 g/mol

Names & identifiers

Preferred name
1-(4-Acetylamino-5-chloro-2-methoxyphenyl)-5-chloropentan-1-one
IUPAC
N-[2-chloro-4-(5-chloropentanoyl)-5-methoxyphenyl]acetamide

Names & synonyms

SCHEMBL7355259NYCQPCOQNLYKQC-UHFFFAOYSA-N1-(4-acetylamino-5-chloro-2-methoxyphenyl)-5-chloro-pentan-1-one1-(4-Acetylamino-5-chloro-2-methoxyphenyl)-5-chloropentan-1-one

Database identifiers

PubChem CID
19081861

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
20

Related reactions

4 records

Linked notes

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