bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane

C27H14Cl4GaN3O3 — CID 140661112

IUPACbis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane
SMILESClc1cc(Cl)c2cccnc2c1O[Ga](Oc1cccc2cccnc12)Oc1c(Cl)cc(Cl)c2cccnc12
InChIInChI=1S/2C9H5Cl2NO.C9H7NO.Ga/c2*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-4,13H;1-6,11H;/q;;;+3/p-3
InChIKeyRLVDFXUWBBVXHR-UHFFFAOYSA-K
MW639.96 g/mol
LogP8.47
Rot. Bonds6

About bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane

bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane (PubChem CID 140661112) has the molecular formula C27H14Cl4GaN3O3 and a molecular weight of 639.96 g/mol. Its IUPAC name is bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane.

Molecular Properties

Compound Namebis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane
PubChem CID140661112
Molecular FormulaC27H14Cl4GaN3O3
Molecular Weight639.96 g/mol
Exact Mass636.90
IUPAC Namebis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane
SMILESClc1cc(Cl)c2cccnc2c1O[Ga](Oc1cccc2cccnc12)Oc1c(Cl)cc(Cl)c2cccnc12
InChIInChI=1S/2C9H5Cl2NO.C9H7NO.Ga/c2*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-4,13H;1-6,11H;/q;;;+3/p-3
InChIKeyRLVDFXUWBBVXHR-UHFFFAOYSA-K
XLogP8.47
TPSA66.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500639.96
LogP ≤ 58.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Halquinol
CID 24690
Tris(5,7-dichloroquinolin-8-olato-N1,O8)aluminium
CID 16685322
Aluminum tris(5,7-dichloroquinolin-8-olate)
CID 22660347
tri(quinolin-8-yloxy)(111In)indigane
CID 16682728
(2R)-7-chloro-2-(2-fluoro-3-pyridinyl)-2-phenyl-3-oxa-1-azonia-2-boranuidatricyclo[6.3.1.04,12]dodeca-1(11),4(12),5,7,9-pentaene
CID 139140160
5,7-Dichloro-8-[(5,5'-ditert-butyl-2,2'-spirobi[1,3,2lambda5-benzodioxaphosphole]-2-yl)oxy]quinoline
CID 360386
(4-Chlorophenyl)-(5,7-dichloroquinolin-8-yl)oxy-(3-fluorophenyl)borane
CID 11654875
(7-Chloro-5-fluoroquinolin-8-yl)oxy-bis[(5-fluoroquinolin-8-yl)oxy]alumane
CID 58068087
5,7-Dichloroquinolin-8-yl piperidine-1-sulfonate
CID 11841639
5-Chloroquinolin-8-ol; 7-chloroquinolin-8-ol
CID 476194
4-Chloroquinolin-8-ol; 7-chloroquinolin-8-ol
CID 476196
3-Chloroquinolin-8-ol; 7-chloroquinolin-8-ol
CID 476198

Frequently Asked Questions

What is the IUPAC name of bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane?
The IUPAC name of bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane (CID 140661112) is bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane.
What is the SMILES notation for bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane?
The canonical SMILES for bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane is Clc1cc(Cl)c2cccnc2c1O[Ga](Oc1cccc2cccnc12)Oc1c(Cl)cc(Cl)c2cccnc12.
What is the InChIKey of bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane?
The InChIKey is RLVDFXUWBBVXHR-UHFFFAOYSA-K. The full InChI is InChI=1S/2C9H5Cl2NO.C9H7NO.Ga/c2*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-4,13H;1-6,11H;/q;;;+3/p-3.
What are the key properties of bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane?
bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane has a molecular weight of 639.96 g/mol, XLogP of 8.47, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis[(5,7-dichloroquinolin-8-yl)oxy]-quinolin-8-yloxygallane is sourced from PubChem (CID 140661112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).