4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide

C10H8Cl2N2O2S2 — CID 61299181

IUPAC4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C10H8Cl2N2O2S2/c11-6-1-2-8(12)9(3-6)14-18(15,16)10-4-7(13)5-17-10/h1-5,14H,13H2
InChIKeyJCTWFDDSOURDDH-UHFFFAOYSA-N
MW323.23 g/mol
LogP3.44
Rot. Bonds3

About 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide

4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide (PubChem CID 61299181) has the molecular formula C10H8Cl2N2O2S2 and a molecular weight of 323.23 g/mol. Its IUPAC name is 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide
PubChem CID61299181
Molecular FormulaC10H8Cl2N2O2S2
Molecular Weight323.23 g/mol
Exact Mass321.94
IUPAC Name4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C10H8Cl2N2O2S2/c11-6-1-2-8(12)9(3-6)14-18(15,16)10-4-7(13)5-17-10/h1-5,14H,13H2
InChIKeyJCTWFDDSOURDDH-UHFFFAOYSA-N
XLogP3.44
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.23
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide (CID 61299181) is 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide is Nc1csc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1.
What is the InChIKey of 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide?
The InChIKey is JCTWFDDSOURDDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2O2S2/c11-6-1-2-8(12)9(3-6)14-18(15,16)10-4-7(13)5-17-10/h1-5,14H,13H2.
What are the key properties of 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide?
4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide has a molecular weight of 323.23 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 61299181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).