5,7-Dichloro-4-(3-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester

HCID 10177042
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Basic information

Standard SMILES
CCOC(=O)C1CC(c2cccc(F)c2)c2c(Cl)cc(Cl)cc2N1
InChIKey
WERYPXKSYVMXBV-UHFFFAOYSA-N
Molecular formula
C18H16Cl2FNO2
Average molar mass
368.2 g/mol

Names & identifiers

Preferred name
5,7-Dichloro-4-(3-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester
IUPAC
ethyl 5,7-dichloro-4-(3-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxylate

Names & synonyms

SCHEMBL6770378WERYPXKSYVMXBV-UHFFFAOYSA-N5,7-dichloro-4-(3-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester

Database identifiers

PubChem CID
10177042

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
24

Related reactions

2 records
New reaction record

Linked notes

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