(E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide

C16H15Cl2NO2S — CID 9301836

IUPAC(E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccc(Cl)cc1)NCCc1cccc(Cl)c1
InChIInChI=1S/C16H15Cl2NO2S/c17-15-6-4-13(5-7-15)9-11-22(20,21)19-10-8-14-2-1-3-16(18)12-14/h1-7,9,11-12,19H,8,10H2/b11-9+
InChIKeyHIJOWGDWQOTXGG-PKNBQFBNSA-N
MW356.27 g/mol
LogP4.13
Rot. Bonds6

About (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide

(E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide (PubChem CID 9301836) has the molecular formula C16H15Cl2NO2S and a molecular weight of 356.27 g/mol. Its IUPAC name is (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide.

Molecular Properties

Compound Name(E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide
PubChem CID9301836
Molecular FormulaC16H15Cl2NO2S
Molecular Weight356.27 g/mol
Exact Mass355.02
IUPAC Name(E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide
SMILESO=S(=O)(/C=C/c1ccc(Cl)cc1)NCCc1cccc(Cl)c1
InChIInChI=1S/C16H15Cl2NO2S/c17-15-6-4-13(5-7-15)9-11-22(20,21)19-10-8-14-2-1-3-16(18)12-14/h1-7,9,11-12,19H,8,10H2/b11-9+
InChIKeyHIJOWGDWQOTXGG-PKNBQFBNSA-N
XLogP4.13
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.27
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide?
The IUPAC name of (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide (CID 9301836) is (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide.
What is the SMILES notation for (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide?
The canonical SMILES for (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide is O=S(=O)(/C=C/c1ccc(Cl)cc1)NCCc1cccc(Cl)c1.
What is the InChIKey of (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide?
The InChIKey is HIJOWGDWQOTXGG-PKNBQFBNSA-N. The full InChI is InChI=1S/C16H15Cl2NO2S/c17-15-6-4-13(5-7-15)9-11-22(20,21)19-10-8-14-2-1-3-16(18)12-14/h1-7,9,11-12,19H,8,10H2/b11-9+.
What are the key properties of (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide?
(E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide has a molecular weight of 356.27 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(4-chlorophenyl)-N-[2-(3-chlorophenyl)ethyl]ethenesulfonamide is sourced from PubChem (CID 9301836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).