3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide

C12H8Cl3FN2O2S — CID 2743290

IUPAC3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide
SMILESO=S(=O)(NNc1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C12H8Cl3FN2O2S/c13-8-5-4-7(6-10(8)15)21(19,20)18-17-12-9(14)2-1-3-11(12)16/h1-6,17-18H
InChIKeyDCEQKETWSZIRSX-UHFFFAOYSA-N
MW369.63 g/mol
LogP4.09
Rot. Bonds4

About 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide

3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide (PubChem CID 2743290) has the molecular formula C12H8Cl3FN2O2S and a molecular weight of 369.63 g/mol. Its IUPAC name is 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide.

Molecular Properties

Compound Name3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide
PubChem CID2743290
Molecular FormulaC12H8Cl3FN2O2S
Molecular Weight369.63 g/mol
Exact Mass367.94
IUPAC Name3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide
SMILESO=S(=O)(NNc1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C12H8Cl3FN2O2S/c13-8-5-4-7(6-10(8)15)21(19,20)18-17-12-9(14)2-1-3-11(12)16/h1-6,17-18H
InChIKeyDCEQKETWSZIRSX-UHFFFAOYSA-N
XLogP4.09
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.63
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,4-dichloro-N'-(4-methylphenyl)sulfonylbenzenesulfonohydrazide
CID 8500653
3,4-dichloro-N'-(4-propan-2-ylphenyl)benzenesulfonohydrazide
CID 2743187
5,6-dichloro-N-(2,6-difluorophenyl)pyridine-3-sulfonamide
CID 64625188
N-(2-chloro-6-fluorophenyl)-4-cyano-3-methylbenzenesulfonamide
CID 106919890
3,4-dichlorobenzenesulfonohydrazide
CID 2735965
N-(2,6-difluorophenyl)-3,4-difluorobenzenesulfonamide
CID 8500850
3-[(2,4,6-trichloroanilino)sulfamoyl]benzenesulfonamide
CID 31064906
3-(3,4-dichlorophenyl)sulfonyl-N-methylbenzenesulfonamide
CID 71590941
3-(3,4-dichlorophenyl)sulfonyl-N-(3-fluorophenyl)benzenesulfonamide
CID 134089881
3,4-dichloro-N-(4-fluoro-2-hydroxyphenyl)benzenesulfonamide
CID 63677626
3,4-dichloro-N-(2-fluoroethyl)benzenesulfonamide
CID 87814655
3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
CID 74229116

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide?
The IUPAC name of 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide (CID 2743290) is 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide.
What is the SMILES notation for 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide?
The canonical SMILES for 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide is O=S(=O)(NNc1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide?
The InChIKey is DCEQKETWSZIRSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl3FN2O2S/c13-8-5-4-7(6-10(8)15)21(19,20)18-17-12-9(14)2-1-3-11(12)16/h1-6,17-18H.
What are the key properties of 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide?
3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide has a molecular weight of 369.63 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N'-(2-chloro-6-fluorophenyl)benzenesulfonohydrazide is sourced from PubChem (CID 2743290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).