2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide

C15H11Cl2NO4S — CID 69116704

IUPAC2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide
SMILESO=C(NS(=O)(=O)C=Cc1cccc(O)c1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H11Cl2NO4S/c16-11-4-5-13(14(17)9-11)15(20)18-23(21,22)7-6-10-2-1-3-12(19)8-10/h1-9,19H,(H,18,20)
InChIKeyHINAMQGOTPLTNG-UHFFFAOYSA-N
MW372.23 g/mol
LogP3.43
Rot. Bonds4

About 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide

2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide (PubChem CID 69116704) has the molecular formula C15H11Cl2NO4S and a molecular weight of 372.23 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide
PubChem CID69116704
Molecular FormulaC15H11Cl2NO4S
Molecular Weight372.23 g/mol
Exact Mass370.98
IUPAC Name2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide
SMILESO=C(NS(=O)(=O)C=Cc1cccc(O)c1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H11Cl2NO4S/c16-11-4-5-13(14(17)9-11)15(20)18-23(21,22)7-6-10-2-1-3-12(19)8-10/h1-9,19H,(H,18,20)
InChIKeyHINAMQGOTPLTNG-UHFFFAOYSA-N
XLogP3.43
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.23
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide (CID 69116704) is 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide is O=C(NS(=O)(=O)C=Cc1cccc(O)c1)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide?
The InChIKey is HINAMQGOTPLTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO4S/c16-11-4-5-13(14(17)9-11)15(20)18-23(21,22)7-6-10-2-1-3-12(19)8-10/h1-9,19H,(H,18,20).
What are the key properties of 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide?
2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide has a molecular weight of 372.23 g/mol, XLogP of 3.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-(3-hydroxyphenyl)ethenylsulfonyl]benzamide is sourced from PubChem (CID 69116704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).