5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide

C12H10Cl2N2O4S2 — CID 2105717

IUPAC5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(Cl)s1
InChIInChI=1S/C12H10Cl2N2O4S2/c1-20-9-3-2-7(13)6-8(9)12(17)15-16-22(18,19)11-5-4-10(14)21-11/h2-6,16H,1H3,(H,15,17)
InChIKeyFTDRTXCHMDPIFC-UHFFFAOYSA-N
MW381.26 g/mol
LogP2.69
Rot. Bonds5

About 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide

5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide (PubChem CID 2105717) has the molecular formula C12H10Cl2N2O4S2 and a molecular weight of 381.26 g/mol. Its IUPAC name is 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide.

Molecular Properties

Compound Name5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide
PubChem CID2105717
Molecular FormulaC12H10Cl2N2O4S2
Molecular Weight381.26 g/mol
Exact Mass379.95
IUPAC Name5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(Cl)s1
InChIInChI=1S/C12H10Cl2N2O4S2/c1-20-9-3-2-7(13)6-8(9)12(17)15-16-22(18,19)11-5-4-10(14)21-11/h2-6,16H,1H3,(H,15,17)
InChIKeyFTDRTXCHMDPIFC-UHFFFAOYSA-N
XLogP2.69
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.26
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide?
The IUPAC name of 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide (CID 2105717) is 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide.
What is the SMILES notation for 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide?
The canonical SMILES for 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide is COc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide?
The InChIKey is FTDRTXCHMDPIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O4S2/c1-20-9-3-2-7(13)6-8(9)12(17)15-16-22(18,19)11-5-4-10(14)21-11/h2-6,16H,1H3,(H,15,17).
What are the key properties of 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide?
5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide has a molecular weight of 381.26 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N'-(5-chlorothiophen-2-yl)sulfonyl-2-methoxybenzohydrazide is sourced from PubChem (CID 2105717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).