2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide

C10H9Cl2N3O2S2 — CID 63944797

IUPAC2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(N)sc1S(=O)(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C10H9Cl2N3O2S2/c1-5-9(18-10(13)14-5)19(16,17)15-8-4-6(11)2-3-7(8)12/h2-4,15H,1H3,(H2,13,14)
InChIKeySXPLFPXSNUAFJF-UHFFFAOYSA-N
MW338.24 g/mol
LogP3.14
Rot. Bonds3

About 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide

2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 63944797) has the molecular formula C10H9Cl2N3O2S2 and a molecular weight of 338.24 g/mol. Its IUPAC name is 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
PubChem CID63944797
Molecular FormulaC10H9Cl2N3O2S2
Molecular Weight338.24 g/mol
Exact Mass336.95
IUPAC Name2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(N)sc1S(=O)(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C10H9Cl2N3O2S2/c1-5-9(18-10(13)14-5)19(16,17)15-8-4-6(11)2-3-7(8)12/h2-4,15H,1H3,(H2,13,14)
InChIKeySXPLFPXSNUAFJF-UHFFFAOYSA-N
XLogP3.14
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.24
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide (CID 63944797) is 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide is Cc1nc(N)sc1S(=O)(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is SXPLFPXSNUAFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3O2S2/c1-5-9(18-10(13)14-5)19(16,17)15-8-4-6(11)2-3-7(8)12/h2-4,15H,1H3,(H2,13,14).
What are the key properties of 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide?
2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 338.24 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,5-dichlorophenyl)-4-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 63944797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).