N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide

C9H10Cl2N2O3S — CID 8505483

IUPACN'-(2,3-dichlorophenyl)sulfonylpropanehydrazide
SMILESCCC(=O)NNS(=O)(=O)c1cccc(Cl)c1Cl
InChIInChI=1S/C9H10Cl2N2O3S/c1-2-8(14)12-13-17(15,16)7-5-3-4-6(10)9(7)11/h3-5,13H,2H2,1H3,(H,12,14)
InChIKeyVALVJPMYQGACLF-UHFFFAOYSA-N
MW297.16 g/mol
LogP1.71
Rot. Bonds4

About N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide

N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide (PubChem CID 8505483) has the molecular formula C9H10Cl2N2O3S and a molecular weight of 297.16 g/mol. Its IUPAC name is N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide.

Molecular Properties

Compound NameN'-(2,3-dichlorophenyl)sulfonylpropanehydrazide
PubChem CID8505483
Molecular FormulaC9H10Cl2N2O3S
Molecular Weight297.16 g/mol
Exact Mass295.98
IUPAC NameN'-(2,3-dichlorophenyl)sulfonylpropanehydrazide
SMILESCCC(=O)NNS(=O)(=O)c1cccc(Cl)c1Cl
InChIInChI=1S/C9H10Cl2N2O3S/c1-2-8(14)12-13-17(15,16)7-5-3-4-6(10)9(7)11/h3-5,13H,2H2,1H3,(H,12,14)
InChIKeyVALVJPMYQGACLF-UHFFFAOYSA-N
XLogP1.71
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.16
LogP ≤ 51.71
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

tert-butyl N-[(2,3-dichlorophenyl)sulfonylamino]carbamate
CID 8500966
methyl 2-[(propanoylamino)sulfamoyl]benzoate
CID 8505481
N'-(2,3-dichlorophenyl)sulfonyl-2-[(3R)-1,1-dioxothiolan-3-yl]acetohydrazide
CID 8842075
ethyl N-[(3-chloro-2-fluorophenyl)sulfonylamino]carbamate
CID 47309506
N'-(3-chloro-4-fluorophenyl)sulfonylpropanehydrazide
CID 8505477
2-[[(2,3-dichlorophenyl)sulfonylamino]methyl]butanoic acid
CID 65222532
2,3-dichloro-N'-(4-methylphenyl)sulfonylbenzenesulfonohydrazide
CID 8500668
2,3-dichloro-N-[(2S)-2-hydroxypropyl]benzenesulfonamide
CID 83030309
2,3-dichloro-N-(2-oxo-2-piperidin-1-ylethyl)benzenesulfonamide
CID 39668267
2,3-dichloro-N-[2-(diethylamino)ethyl]benzenesulfonamide
CID 8716586
tert-butyl N-[(2-chlorophenyl)sulfonylamino]carbamate
CID 8500976
2,3-dichloro-N-(3-hydroxybutyl)benzenesulfonamide
CID 64912476

Frequently Asked Questions

What is the IUPAC name of N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide?
The IUPAC name of N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide (CID 8505483) is N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide.
What is the SMILES notation for N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide?
The canonical SMILES for N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide is CCC(=O)NNS(=O)(=O)c1cccc(Cl)c1Cl.
What is the InChIKey of N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide?
The InChIKey is VALVJPMYQGACLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N2O3S/c1-2-8(14)12-13-17(15,16)7-5-3-4-6(10)9(7)11/h3-5,13H,2H2,1H3,(H,12,14).
What are the key properties of N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide?
N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide has a molecular weight of 297.16 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,3-dichlorophenyl)sulfonylpropanehydrazide is sourced from PubChem (CID 8505483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).