(2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone

C8H7Cl2NO3S2 — CID 71888730

IUPAC(2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone
SMILESO=C(c1cc(Cl)sc1Cl)N1CCCS1(=O)=O
InChIInChI=1S/C8H7Cl2NO3S2/c9-6-4-5(7(10)15-6)8(12)11-2-1-3-16(11,13)14/h4H,1-3H2
InChIKeyXSKJDLFMMYGXFD-UHFFFAOYSA-N
MW300.19 g/mol
LogP2.23
Rot. Bonds1

About (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone

(2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone (PubChem CID 71888730) has the molecular formula C8H7Cl2NO3S2 and a molecular weight of 300.19 g/mol. Its IUPAC name is (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone.

Molecular Properties

Compound Name(2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone
PubChem CID71888730
Molecular FormulaC8H7Cl2NO3S2
Molecular Weight300.19 g/mol
Exact Mass298.92
IUPAC Name(2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone
SMILESO=C(c1cc(Cl)sc1Cl)N1CCCS1(=O)=O
InChIInChI=1S/C8H7Cl2NO3S2/c9-6-4-5(7(10)15-6)8(12)11-2-1-3-16(11,13)14/h4H,1-3H2
InChIKeyXSKJDLFMMYGXFD-UHFFFAOYSA-N
XLogP2.23
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.19
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone?
The IUPAC name of (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone (CID 71888730) is (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone.
What is the SMILES notation for (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone?
The canonical SMILES for (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone is O=C(c1cc(Cl)sc1Cl)N1CCCS1(=O)=O.
What is the InChIKey of (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone?
The InChIKey is XSKJDLFMMYGXFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Cl2NO3S2/c9-6-4-5(7(10)15-6)8(12)11-2-1-3-16(11,13)14/h4H,1-3H2.
What are the key properties of (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone?
(2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone has a molecular weight of 300.19 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dichlorothiophen-3-yl)-(1,1-dioxo-1,2-thiazolidin-2-yl)methanone is sourced from PubChem (CID 71888730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).