6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline

C24H19Cl2NO2 — CID 155528177

IUPAC6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline
SMILESCOc1ccc(-c2cc(COCc3ccccc3)c3cc(Cl)c(Cl)cc3n2)cc1
InChIInChI=1S/C24H19Cl2NO2/c1-28-19-9-7-17(8-10-19)23-11-18(15-29-14-16-5-3-2-4-6-16)20-12-21(25)22(26)13-24(20)27-23/h2-13H,14-15H2,1H3
InChIKeyWHOMPMORYAUSAQ-UHFFFAOYSA-N
MW424.33 g/mol
LogP6.93
Rot. Bonds6

About 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline

6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline (PubChem CID 155528177) has the molecular formula C24H19Cl2NO2 and a molecular weight of 424.33 g/mol. Its IUPAC name is 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline.

Molecular Properties

Compound Name6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline
PubChem CID155528177
Molecular FormulaC24H19Cl2NO2
Molecular Weight424.33 g/mol
Exact Mass423.08
IUPAC Name6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline
SMILESCOc1ccc(-c2cc(COCc3ccccc3)c3cc(Cl)c(Cl)cc3n2)cc1
InChIInChI=1S/C24H19Cl2NO2/c1-28-19-9-7-17(8-10-19)23-11-18(15-29-14-16-5-3-2-4-6-16)20-12-21(25)22(26)13-24(20)27-23/h2-13H,14-15H2,1H3
InChIKeyWHOMPMORYAUSAQ-UHFFFAOYSA-N
XLogP6.93
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.33
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,9-Dichloro-7-methoxyacridine
CID 66577
N-(3,4-dichlorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 825303
6-chloro-2-methoxy-N-(4-methoxybenzyl)acridin-9-amine
CID 101124554
Antibacterial agent 96
CID 162652204
6-Chloro-3-(3,4-dimethoxyphenyl)-2-methyl-4-phenylquinoline
CID 2809389
6-Chloro-2-methoxy-9-phenoxyacridine
CID 345321
2-Chloro-7-methoxy-4-methylquinoline
CID 732214
6-Chloro-N-(4-methoxybenzyl)-1,2,3,4-tetrahydroacridin-9-amine (9d)
CID 122199178
sodium 4-[3-[(E)-2-(6,7-dichloroquinolin-2-yl)ethenyl]phenoxy]butanoate
CID 23689564
1-[7-Chloro-2-(4-methoxyphenyl)quinolin-4-yl]-2-(diethylamino)ethanol;hydrochloride
CID 24188326
6-chloro-2-methoxy-N-(4-methoxyphenyl)acridin-9-amine;hydrochloride
CID 44531580
(E)-3-[6-chloro-4-(4-methoxyphenyl)quinolin-2-yl]prop-2-en-1-ol
CID 73349482

Frequently Asked Questions

What is the IUPAC name of 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline?
The IUPAC name of 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline (CID 155528177) is 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline.
What is the SMILES notation for 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline?
The canonical SMILES for 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline is COc1ccc(-c2cc(COCc3ccccc3)c3cc(Cl)c(Cl)cc3n2)cc1.
What is the InChIKey of 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline?
The InChIKey is WHOMPMORYAUSAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19Cl2NO2/c1-28-19-9-7-17(8-10-19)23-11-18(15-29-14-16-5-3-2-4-6-16)20-12-21(25)22(26)13-24(20)27-23/h2-13H,14-15H2,1H3.
What are the key properties of 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline?
6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline has a molecular weight of 424.33 g/mol, XLogP of 6.93, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dichloro-2-(4-methoxyphenyl)-4-(phenylmethoxymethyl)quinoline is sourced from PubChem (CID 155528177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).