4-(4-Chloro-5-methoxy-2-methylanilino)-7-methoxy-8-(chloroethoxy)benzo[g]quinoline-3-carbonitrile

HCID 11511367
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Basic information

Standard SMILES
COc1cc(Nc2c(C#N)cnc3cc4cc(OCCCl)c(OC)cc4cc23)c(C)cc1Cl
InChIKey
OQTZCZMQFNKRTQ-UHFFFAOYSA-N
Molecular formula
C25H21Cl2N3O3
Average molar mass
482.4 g/mol
Monoisotopic mass
481.0959969

Names & identifiers

Preferred name
4-(4-Chloro-5-methoxy-2-methylanilino)-7-methoxy-8-(chloroethoxy)benzo[g]quinoline-3-carbonitrile
IUPAC
8-(2-chloroethoxy)-4-(4-chloro-5-methoxy-2-methylanilino)-7-methoxybenzo[g]quinoline-3-carbonitrile

Names & synonyms

SCHEMBL5254864OQTZCZMQFNKRTQ-UHFFFAOYSA-N4-(4-chloro-5-methoxy-2-methylanilino)-7-methoxy-8-(chloroethoxy)benzo[g]quinoline-3-carbonitrile

Database identifiers

PubChem CID
11511367

Properties

Computed structural properties

XLogP
6.7
Topological polar surface area
76.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
33

Related reactions

7 records
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Compound notes

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