4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol

C15H9Cl2NO2 — CID 11208953

IUPAC4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol
SMILESOc1ccc(Cl)cc1Oc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H9Cl2NO2/c16-9-3-5-12(19)14(8-9)20-13-6-4-11(17)10-2-1-7-18-15(10)13/h1-8,19H
InChIKeyPXDPCRTVJVDTRN-UHFFFAOYSA-N
MW306.15 g/mol
LogP5.04
Rot. Bonds2

About 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol

4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol (PubChem CID 11208953) has the molecular formula C15H9Cl2NO2 and a molecular weight of 306.15 g/mol. Its IUPAC name is 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol.

Molecular Properties

Compound Name4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol
PubChem CID11208953
Molecular FormulaC15H9Cl2NO2
Molecular Weight306.15 g/mol
Exact Mass305.00
IUPAC Name4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol
SMILESOc1ccc(Cl)cc1Oc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H9Cl2NO2/c16-9-3-5-12(19)14(8-9)20-13-6-4-11(17)10-2-1-7-18-15(10)13/h1-8,19H
InChIKeyPXDPCRTVJVDTRN-UHFFFAOYSA-N
XLogP5.04
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.15
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol?
The IUPAC name of 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol (CID 11208953) is 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol.
What is the SMILES notation for 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol?
The canonical SMILES for 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol is Oc1ccc(Cl)cc1Oc1ccc(Cl)c2cccnc12.
What is the InChIKey of 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol?
The InChIKey is PXDPCRTVJVDTRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2NO2/c16-9-3-5-12(19)14(8-9)20-13-6-4-11(17)10-2-1-7-18-15(10)13/h1-8,19H.
What are the key properties of 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol?
4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol has a molecular weight of 306.15 g/mol, XLogP of 5.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(5-chloroquinolin-8-yl)oxyphenol is sourced from PubChem (CID 11208953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).