(2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone

C15H8F2OS2 — CID 2739862

IUPAC(2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone
SMILESO=C(c1ccc(-c2cccs2)s1)c1ccc(F)cc1F
InChIInChI=1S/C15H8F2OS2/c16-9-3-4-10(11(17)8-9)15(18)14-6-5-13(20-14)12-2-1-7-19-12/h1-8H
InChIKeyLBYRUTLHZQZRFG-UHFFFAOYSA-N
MW306.36 g/mol
LogP4.99
Rot. Bonds3

About (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone

(2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone (PubChem CID 2739862) has the molecular formula C15H8F2OS2 and a molecular weight of 306.36 g/mol. Its IUPAC name is (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone.

Molecular Properties

Compound Name(2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone
PubChem CID2739862
Molecular FormulaC15H8F2OS2
Molecular Weight306.36 g/mol
Exact Mass306.00
IUPAC Name(2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone
SMILESO=C(c1ccc(-c2cccs2)s1)c1ccc(F)cc1F
InChIInChI=1S/C15H8F2OS2/c16-9-3-4-10(11(17)8-9)15(18)14-6-5-13(20-14)12-2-1-7-19-12/h1-8H
InChIKeyLBYRUTLHZQZRFG-UHFFFAOYSA-N
XLogP4.99
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Acetylbenzothiophene
CID 89805
1-(5-Phenylthiophen-2-yl)ethan-1-one
CID 4962481
2-Benzoylthiophene
CID 67262
3-Acetylbenzothiophene
CID 14316
3-Phenyl-1-(thien-2-yl)prop-2-en-1-one
CID 19891
5-Acetyl-2,2'-bithienyl
CID 606422
(2E)-3-phenyl-1-(thiophen-2-yl)prop-2-en-1-one
CID 5702653
(2E)-2-[(Thiophen-2-YL)methylidene]-2,3-dihydro-1H-inden-1-one
CID 2305465
(Benzo(1,2-b:4,5-b)dithiophene-4,8-dione)
CID 288478
1,7-Dithia-s-indacene-4,8-dione
CID 288496
2-[5-(2-Fluorobenzoyl)-2-thienyl]acetonitrile
CID 2774431
2-Phenyl-1-(2-thienyl)ethanone
CID 687090

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone?
The IUPAC name of (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone (CID 2739862) is (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone.
What is the SMILES notation for (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone?
The canonical SMILES for (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone is O=C(c1ccc(-c2cccs2)s1)c1ccc(F)cc1F.
What is the InChIKey of (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone?
The InChIKey is LBYRUTLHZQZRFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F2OS2/c16-9-3-4-10(11(17)8-9)15(18)14-6-5-13(20-14)12-2-1-7-19-12/h1-8H.
What are the key properties of (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone?
(2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone has a molecular weight of 306.36 g/mol, XLogP of 4.99, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-(5-thiophen-2-ylthiophen-2-yl)methanone is sourced from PubChem (CID 2739862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).