2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide

C11H8Cl2N4O4S — CID 7230554

IUPAC2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide
SMILESO=[N+]([O-])c1ccc(NNS(=O)(=O)c2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C11H8Cl2N4O4S/c12-7-1-3-9(13)10(5-7)22(20,21)16-15-11-4-2-8(6-14-11)17(18)19/h1-6,16H,(H,14,15)
InChIKeyXFLBUWGBNRNFRL-UHFFFAOYSA-N
MW363.18 g/mol
LogP2.60
Rot. Bonds5

About 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide

2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide (PubChem CID 7230554) has the molecular formula C11H8Cl2N4O4S and a molecular weight of 363.18 g/mol. Its IUPAC name is 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide.

Molecular Properties

Compound Name2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide
PubChem CID7230554
Molecular FormulaC11H8Cl2N4O4S
Molecular Weight363.18 g/mol
Exact Mass361.96
IUPAC Name2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide
SMILESO=[N+]([O-])c1ccc(NNS(=O)(=O)c2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C11H8Cl2N4O4S/c12-7-1-3-9(13)10(5-7)22(20,21)16-15-11-4-2-8(6-14-11)17(18)19/h1-6,16H,(H,14,15)
InChIKeyXFLBUWGBNRNFRL-UHFFFAOYSA-N
XLogP2.60
TPSA114.23 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.18
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-Nitrobenzenesulfonic acid 2-(3-nitro-2-pyridinyl)hydrazide
CID 5052243
N-{4-[(2-{3-nitro-2-pyridinyl}hydrazino)sulfonyl]phenyl}acetamide
CID 4051803
Piperazine, 1-[(4-chlorophenyl)sulfonyl]-4-(5-nitro-2-pyridinyl)-
CID 2799448
N-(5-chloropyridin-2-yl)-3-nitrobenzenesulfonamide
CID 2886168
2,3-dichloro-N'-pyridin-2-ylbenzenesulfonohydrazide
CID 8893123
1-(3-Chloro-4-fluorophenyl)sulfonyl-4-(5-nitro-2-pyridinyl)piperazine
CID 2799446
4-chloro-3-nitro-N'-[5-(trifluoromethyl)-2-pyridinyl]benzenesulfonohydrazide
CID 4856169
N-(5-Chloro-2-pyridinyl)-4-nitrobenzenesulfonamide
CID 619090
N'-(5-nitropyridin-2-yl)benzenesulfonohydrazide
CID 16044242
N-(5-nitro-2-pyridinyl)benzenesulfonamide
CID 158570402
N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-nitrobenzenesulfonohydrazide
CID 8523466
N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-nitrobenzenesulfonohydrazide
CID 8523473

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide?
The IUPAC name of 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide (CID 7230554) is 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide.
What is the SMILES notation for 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide?
The canonical SMILES for 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide is O=[N+]([O-])c1ccc(NNS(=O)(=O)c2cc(Cl)ccc2Cl)nc1.
What is the InChIKey of 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide?
The InChIKey is XFLBUWGBNRNFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N4O4S/c12-7-1-3-9(13)10(5-7)22(20,21)16-15-11-4-2-8(6-14-11)17(18)19/h1-6,16H,(H,14,15).
What are the key properties of 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide?
2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide has a molecular weight of 363.18 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N'-(5-nitro-2-pyridinyl)benzenesulfonohydrazide is sourced from PubChem (CID 7230554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).