[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane

C22H14F2N4P2 — CID 58299262

IUPAC[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane
SMILESFc1ccc2nc(P)c(-c3ccc(-c4nc5cc(F)ccc5nc4P)cc3)nc2c1
InChIInChI=1S/C22H14F2N4P2/c23-13-5-7-15-17(9-13)25-19(21(29)27-15)11-1-2-12(4-3-11)20-22(30)28-16-8-6-14(24)10-18(16)26-20/h1-10H,29-30H2
InChIKeyOUIVJGGFYHURMB-UHFFFAOYSA-N
MW434.33 g/mol
LogP4.19
Rot. Bonds2

About [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane

[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane (PubChem CID 58299262) has the molecular formula C22H14F2N4P2 and a molecular weight of 434.33 g/mol. Its IUPAC name is [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane.

Molecular Properties

Compound Name[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane
PubChem CID58299262
Molecular FormulaC22H14F2N4P2
Molecular Weight434.33 g/mol
Exact Mass434.07
IUPAC Name[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane
SMILESFc1ccc2nc(P)c(-c3ccc(-c4nc5cc(F)ccc5nc4P)cc3)nc2c1
InChIInChI=1S/C22H14F2N4P2/c23-13-5-7-15-17(9-13)25-19(21(29)27-15)11-1-2-12(4-3-11)20-22(30)28-16-8-6-14(24)10-18(16)26-20/h1-10H,29-30H2
InChIKeyOUIVJGGFYHURMB-UHFFFAOYSA-N
XLogP4.19
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.33
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-2,3-diphenylquinoxaline
CID 3700648
5-fluorocyclobuta[b]quinoxaline-1,2-diol
CID 135502848
2-[5-[7-fluoro-3-(4-fluorophenyl)quinoxalin-2-yl]thiophen-2-yl]-3-(4-fluorophenyl)-6-methylquinoxaline
CID 58299264
2,3-dibromo-6-fluoroquinoxaline
CID 71652953
6-fluoro-2,3-bis(fluoromethyl)quinoxaline
CID 71580364
7-fluorophenazin-2-ol
CID 154115313
7-fluoroindeno[1,2-b]quinoxalin-11-one
CID 122192565
[2,3-bis(4-fluorophenyl)quinoxalin-6-yl]carbamic acid
CID 118453878
2,3,5,6-tetrakis(4-fluorophenyl)pyrazine
CID 132966321
6-[2-[4-[2-[2,3-bis(4-fluorophenyl)quinoxalin-6-yl]ethynyl]phenyl]ethynyl]-2,3-bis(4-fluorophenyl)quinoxaline;2-[4-(6,7-dimethyl-3-phenylquinoxalin-2-yl)phenyl]-6,7-dimethyl-3-phenylquinoxaline;2-[5-[7-fluoro-3-(4-fluorophenyl)quinoxalin-2-yl]thiophen-2-yl]-3-(4-fluorophenyl)-6-methylquinoxaline;[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane;6-methyl-3-[4-(7-methyl-3-phenylquinoxalin-2-yl)phenyl]-2-phenylquinoxaline;11-quinoxalino[3,2-f][1,10]phenanthrolin-11-ylquinoxalino[2,3-f][1,10]phenanthroline
CID 159331146
3-chloro-7-fluoroquinoxalin-2-amine
CID 86625776
1-[[2,3-bis(4-fluorophenyl)quinoxalin-6-yl]methyl]-3-ethylurea
CID 170297200

Frequently Asked Questions

What is the IUPAC name of [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane?
The IUPAC name of [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane (CID 58299262) is [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane.
What is the SMILES notation for [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane?
The canonical SMILES for [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane is Fc1ccc2nc(P)c(-c3ccc(-c4nc5cc(F)ccc5nc4P)cc3)nc2c1.
What is the InChIKey of [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane?
The InChIKey is OUIVJGGFYHURMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F2N4P2/c23-13-5-7-15-17(9-13)25-19(21(29)27-15)11-1-2-12(4-3-11)20-22(30)28-16-8-6-14(24)10-18(16)26-20/h1-10H,29-30H2.
What are the key properties of [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane?
[6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane has a molecular weight of 434.33 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-fluoro-3-[4-(7-fluoro-3-phosphanylquinoxalin-2-yl)phenyl]quinoxalin-2-yl]phosphane is sourced from PubChem (CID 58299262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).