5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole

C24H14F2N6 — CID 132528928

IUPAC5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole
SMILESFc1ccc2c(c1)cc(-c1cc3cc(F)ccc3n1-c1ncccn1)n2-c1ncccn1
InChIInChI=1S/C24H14F2N6/c25-17-3-5-19-15(11-17)13-21(31(19)23-27-7-1-8-28-23)22-14-16-12-18(26)4-6-20(16)32(22)24-29-9-2-10-30-24/h1-14H
InChIKeyZIWYTJSZKHMZTP-UHFFFAOYSA-N
MW424.41 g/mol
LogP5.10
Rot. Bonds3

About 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole

5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole (PubChem CID 132528928) has the molecular formula C24H14F2N6 and a molecular weight of 424.41 g/mol. Its IUPAC name is 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole.

Molecular Properties

Compound Name5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole
PubChem CID132528928
Molecular FormulaC24H14F2N6
Molecular Weight424.41 g/mol
Exact Mass424.12
IUPAC Name5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole
SMILESFc1ccc2c(c1)cc(-c1cc3cc(F)ccc3n1-c1ncccn1)n2-c1ncccn1
InChIInChI=1S/C24H14F2N6/c25-17-3-5-19-15(11-17)13-21(31(19)23-27-7-1-8-28-23)22-14-16-12-18(26)4-6-20(16)32(22)24-29-9-2-10-30-24/h1-14H
InChIKeyZIWYTJSZKHMZTP-UHFFFAOYSA-N
XLogP5.10
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.41
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-aminophenyl)-1-pyrimidin-2-ylindol-5-amine
CID 141497762
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CID 115108043
3-(5-iodo-1-pyrimidin-2-ylindol-2-yl)propanal
CID 135057963
5-bromo-2-prop-2-enyl-1-pyrimidin-2-ylindole
CID 122209133
2-benzyl-5-methyl-1-pyrimidin-2-ylindole
CID 155679285
3-fluoro-1,8-naphthyridine
CID 20531189
2-ethenyl-5-methyl-1-pyrimidin-2-ylindole
CID 155679286
5-fluoro-1-(pyridin-2-ylmethyl)indole
CID 55257545
5-fluoro-2-(4-methylsulfonylphenyl)-1-phenylindole
CID 57129889
5-methoxy-2-prop-2-enyl-1-pyrimidin-2-ylindole
CID 122209129
(5-fluoro-1-methylindol-2-yl)-trimethylsilane
CID 177390478
1-[5-(1-pyrimidin-2-ylindol-2-yl)thiophen-2-yl]ethanone
CID 102106744

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole?
The IUPAC name of 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole (CID 132528928) is 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole.
What is the SMILES notation for 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole?
The canonical SMILES for 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole is Fc1ccc2c(c1)cc(-c1cc3cc(F)ccc3n1-c1ncccn1)n2-c1ncccn1.
What is the InChIKey of 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole?
The InChIKey is ZIWYTJSZKHMZTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H14F2N6/c25-17-3-5-19-15(11-17)13-21(31(19)23-27-7-1-8-28-23)22-14-16-12-18(26)4-6-20(16)32(22)24-29-9-2-10-30-24/h1-14H.
What are the key properties of 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole?
5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole has a molecular weight of 424.41 g/mol, XLogP of 5.10, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(5-fluoro-1-pyrimidin-2-ylindol-2-yl)-1-pyrimidin-2-ylindole is sourced from PubChem (CID 132528928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).