N-[(S)-2-(3,4-Dichlorophenyl)-4-hydroxybutyl]-N-methyl-3-cyano-1-naphthamide

HCID 53679342
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Basic information

Standard SMILES
CN(C[C@@H](CCO)c1ccc(Cl)c(Cl)c1)C(=O)c1cc(C#N)cc2ccccc12
InChIKey
BFMTYQCJXCJXJQ-GOSISDBHSA-N
Molecular formula
C23H20Cl2N2O2
Average molar mass
427.3 g/mol

Names & identifiers

Preferred name
N-[(S)-2-(3,4-Dichlorophenyl)-4-hydroxybutyl]-N-methyl-3-cyano-1-naphthamide
IUPAC
3-cyano-N-[(2S)-2-(3,4-dichlorophenyl)-4-hydroxybutyl]-N-methylnaphthalene-1-carboxamide

Names & synonyms

SCHEMBL756430BFMTYQCJXCJXJQ-GOSISDBHSA-NN-[(S)-2-(3,4-Dichlorophenyl)-4-hydroxybutyl]-N-methyl-3-cyano-1-naphthamide

Database identifiers

PubChem CID
53679342

Properties

Computed structural properties

XLogP
5
Topological polar surface area
64.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
29

Related reactions

6 records
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Compound notes

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