2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide

C15H11Cl2NO4S — CID 15602999

IUPAC2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide
SMILESO=C(NS(=O)(=O)/C=C/c1cccc(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)/b7-6+
InChIKeyHINAMQGOTPLTNG-VOTSOKGWSA-N
MW372.23 g/mol
LogP3.43
Rot. Bonds4

About 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide

2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide (PubChem CID 15602999) has the molecular formula C15H11Cl2NO4S and a molecular weight of 372.23 g/mol. Its IUPAC name is 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide
PubChem CID15602999
Molecular FormulaC15H11Cl2NO4S
Molecular Weight372.23 g/mol
Exact Mass370.98
IUPAC Name2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide
SMILESO=C(NS(=O)(=O)/C=C/c1cccc(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)/b7-6+
InChIKeyHINAMQGOTPLTNG-VOTSOKGWSA-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-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide?
The IUPAC name of 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide (CID 15602999) is 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide.
What is the SMILES notation for 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide?
The canonical SMILES for 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide is O=C(NS(=O)(=O)/C=C/c1cccc(O)c1)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide?
The InChIKey is HINAMQGOTPLTNG-VOTSOKGWSA-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)/b7-6+.
What are the key properties of 2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide?
2,4-dichloro-N-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide 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-[(E)-2-(3-hydroxyphenyl)ethenyl]sulfonylbenzamide is sourced from PubChem (CID 15602999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).