N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide

C17H20N2O5S — CID 2643082

IUPACN'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide
SMILESC=C(NNS(=O)(=O)c1ccccc1)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C17H20N2O5S/c1-12(18-19-25(20,21)14-8-6-5-7-9-14)13-10-15(22-2)17(24-4)16(11-13)23-3/h5-11,18-19H,1H2,2-4H3
InChIKeyUBJUWNGEYLJDMD-UHFFFAOYSA-N
MW364.42 g/mol
LogP2.17
Rot. Bonds8

About N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide

N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide (PubChem CID 2643082) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide.

Molecular Properties

Compound NameN'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide
PubChem CID2643082
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC NameN'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide
SMILESC=C(NNS(=O)(=O)c1ccccc1)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C17H20N2O5S/c1-12(18-19-25(20,21)14-8-6-5-7-9-14)13-10-15(22-2)17(24-4)16(11-13)23-3/h5-11,18-19H,1H2,2-4H3
InChIKeyUBJUWNGEYLJDMD-UHFFFAOYSA-N
XLogP2.17
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-(3-cyanophenyl)sulfonyl-3,4,5-trimethoxybenzohydrazide
CID 8523669
3,4,5-trimethoxy-N'-(4-propan-2-ylphenyl)sulfonylbenzohydrazide
CID 8523659
N'-(3,4-dimethylphenyl)sulfonyl-3,4,5-trimethoxybenzohydrazide
CID 26980277
N'-[1-(1H-pyrrol-2-yl)ethenyl]benzenesulfonohydrazide
CID 2692695
3-hydroxy-N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]naphthalene-2-carbohydrazide
CID 5174774
N'-(benzenesulfonyl)-4-methoxybenzohydrazide
CID 795528
3,4,5-trimethoxy-N-(3-phenylphenyl)sulfonylbenzamide
CID 91328901
3,4,5-trimethoxy-N'-thiophen-2-ylsulfonylbenzohydrazide
CID 8523641
3,4,5-trimethoxy-N'-(4-methyl-3-nitrophenyl)sulfonylbenzohydrazide
CID 26680885
N-[4-(benzenesulfonamidocarbamoyl)phenyl]-3,4-dimethoxybenzenesulfonamide
CID 90786253
N'-(benzenesulfonyl)-3-methoxybenzo[f][1]benzofuran-2-carbohydrazide
CID 10222364
3,4,5-trimethoxy-N'-[1-(3-methoxyphenyl)ethenyl]benzohydrazide
CID 2401018

Frequently Asked Questions

What is the IUPAC name of N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide?
The IUPAC name of N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide (CID 2643082) is N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide.
What is the SMILES notation for N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide?
The canonical SMILES for N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide is C=C(NNS(=O)(=O)c1ccccc1)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide?
The InChIKey is UBJUWNGEYLJDMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-12(18-19-25(20,21)14-8-6-5-7-9-14)13-10-15(22-2)17(24-4)16(11-13)23-3/h5-11,18-19H,1H2,2-4H3.
What are the key properties of N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide?
N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide has a molecular weight of 364.42 g/mol, XLogP of 2.17, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(3,4,5-trimethoxyphenyl)ethenyl]benzenesulfonohydrazide is sourced from PubChem (CID 2643082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).