2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide

C11H8Cl2N2O3S2 — CID 86037910

IUPAC2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide
SMILESCc1ncc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)s1
InChIInChI=1S/C11H8Cl2N2O3S2/c1-6-14-5-10(19-6)20(17,18)15-11(16)8-3-2-7(12)4-9(8)13/h2-5H,1H3,(H,15,16)
InChIKeyGBOZBFGAXPUUHN-UHFFFAOYSA-N
MW351.24 g/mol
LogP2.88
Rot. Bonds3

About 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide

2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide (PubChem CID 86037910) has the molecular formula C11H8Cl2N2O3S2 and a molecular weight of 351.24 g/mol. Its IUPAC name is 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide
PubChem CID86037910
Molecular FormulaC11H8Cl2N2O3S2
Molecular Weight351.24 g/mol
Exact Mass349.94
IUPAC Name2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide
SMILESCc1ncc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)s1
InChIInChI=1S/C11H8Cl2N2O3S2/c1-6-14-5-10(19-6)20(17,18)15-11(16)8-3-2-7(12)4-9(8)13/h2-5H,1H3,(H,15,16)
InChIKeyGBOZBFGAXPUUHN-UHFFFAOYSA-N
XLogP2.88
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.24
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide (CID 86037910) is 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide is Cc1ncc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)s1.
What is the InChIKey of 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide?
The InChIKey is GBOZBFGAXPUUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O3S2/c1-6-14-5-10(19-6)20(17,18)15-11(16)8-3-2-7(12)4-9(8)13/h2-5H,1H3,(H,15,16).
What are the key properties of 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide?
2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide has a molecular weight of 351.24 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]benzamide is sourced from PubChem (CID 86037910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).