1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone

C10H6Cl2OS2 — CID 114967489

IUPAC1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone
SMILESO=C(Cc1ccc(Cl)s1)c1sccc1Cl
InChIInChI=1S/C10H6Cl2OS2/c11-7-3-4-14-10(7)8(13)5-6-1-2-9(12)15-6/h1-4H,5H2
InChIKeySDZDIWTXYHWROW-UHFFFAOYSA-N
MW277.20 g/mol
LogP4.54
Rot. Bonds3

About 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone

1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone (PubChem CID 114967489) has the molecular formula C10H6Cl2OS2 and a molecular weight of 277.20 g/mol. Its IUPAC name is 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone.

Molecular Properties

Compound Name1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone
PubChem CID114967489
Molecular FormulaC10H6Cl2OS2
Molecular Weight277.20 g/mol
Exact Mass275.92
IUPAC Name1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone
SMILESO=C(Cc1ccc(Cl)s1)c1sccc1Cl
InChIInChI=1S/C10H6Cl2OS2/c11-7-3-4-14-10(7)8(13)5-6-1-2-9(12)15-6/h1-4H,5H2
InChIKeySDZDIWTXYHWROW-UHFFFAOYSA-N
XLogP4.54
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.20
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chlorothiophen-2-yl)-2-(3,4-dichlorophenyl)ethanone
CID 80529728
2-(5-chlorothiophen-2-yl)-1-(4-methoxyphenyl)ethanone
CID 55096306
2-(5-chlorothiophen-2-yl)-1-(cyclopenten-1-yl)ethanone
CID 103447988
1-(3-chlorothiophen-2-yl)-2-(4-methoxyphenyl)ethanone
CID 80530028
1-(3-chlorothiophen-2-yl)-2-methylsulfanylethanone
CID 80645182
1-(3-chlorothiophen-2-yl)-2-(cyclohexen-1-yl)ethanone
CID 107359442
1-(1-benzothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone
CID 114967597
2-(5-chlorothiophen-2-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone
CID 114967457
1-(3-chlorothiophen-2-yl)pent-3-yn-1-one
CID 114964884
2-[5-[[(5-chlorothiophen-2-yl)methylamino]methyl]thiophen-2-yl]acetic acid
CID 82894964
1-(3-bromophenyl)-2-(5-chlorothiophen-2-yl)ethanone
CID 62620401
4-(tert-butylamino)-1-(5-chlorothiophen-2-yl)butan-2-one
CID 116557955

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone?
The IUPAC name of 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone (CID 114967489) is 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone.
What is the SMILES notation for 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone?
The canonical SMILES for 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone is O=C(Cc1ccc(Cl)s1)c1sccc1Cl.
What is the InChIKey of 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone?
The InChIKey is SDZDIWTXYHWROW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2OS2/c11-7-3-4-14-10(7)8(13)5-6-1-2-9(12)15-6/h1-4H,5H2.
What are the key properties of 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone?
1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone has a molecular weight of 277.20 g/mol, XLogP of 4.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorothiophen-2-yl)-2-(5-chlorothiophen-2-yl)ethanone is sourced from PubChem (CID 114967489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).