4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide

C11H9ClN2O3S2 — CID 8500420

IUPAC4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide
SMILESO=C(NNS(=O)(=O)c1cccs1)c1ccc(Cl)cc1
InChIInChI=1S/C11H9ClN2O3S2/c12-9-5-3-8(4-6-9)11(15)13-14-19(16,17)10-2-1-7-18-10/h1-7,14H,(H,13,15)
InChIKeyKYVINLDXKDJYAO-UHFFFAOYSA-N
MW316.79 g/mol
LogP2.02
Rot. Bonds4

About 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide

4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide (PubChem CID 8500420) has the molecular formula C11H9ClN2O3S2 and a molecular weight of 316.79 g/mol. Its IUPAC name is 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide.

Molecular Properties

Compound Name4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide
PubChem CID8500420
Molecular FormulaC11H9ClN2O3S2
Molecular Weight316.79 g/mol
Exact Mass315.97
IUPAC Name4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide
SMILESO=C(NNS(=O)(=O)c1cccs1)c1ccc(Cl)cc1
InChIInChI=1S/C11H9ClN2O3S2/c12-9-5-3-8(4-6-9)11(15)13-14-19(16,17)10-2-1-7-18-10/h1-7,14H,(H,13,15)
InChIKeyKYVINLDXKDJYAO-UHFFFAOYSA-N
XLogP2.02
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.79
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955
N'-thiophen-2-ylsulfonylacetohydrazide
CID 8500698
3,4,5-trimethoxy-N'-thiophen-2-ylsulfonylbenzohydrazide
CID 8523641
N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-N-methylthiophene-2-sulfonamide
CID 17485175
N-[(E)-(4-chlorophenyl)methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 18206532
N,4-dimethyl-N-[[4-[(thiophen-2-ylsulfonylamino)carbamoyl]phenyl]methyl]benzenesulfonamide
CID 2507621
N'-(4-chlorophenyl)sulfonyl-4-methylbenzohydrazide
CID 932051
2,5-dimethyl-N'-thiophen-2-ylsulfonylfuran-3-carbohydrazide
CID 26980778
2-chloro-N-thiophen-2-ylsulfonylbenzamide
CID 975839
N'-(4-chlorobenzoyl)pyridine-4-carbohydrazide
CID 960057
N-[3-[[[2-(4-chlorophenyl)sulfanylacetyl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide
CID 166191023
N-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 42923725

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide?
The IUPAC name of 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide (CID 8500420) is 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide.
What is the SMILES notation for 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide?
The canonical SMILES for 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide is O=C(NNS(=O)(=O)c1cccs1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide?
The InChIKey is KYVINLDXKDJYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O3S2/c12-9-5-3-8(4-6-9)11(15)13-14-19(16,17)10-2-1-7-18-10/h1-7,14H,(H,13,15).
What are the key properties of 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide?
4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide has a molecular weight of 316.79 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N'-thiophen-2-ylsulfonylbenzohydrazide is sourced from PubChem (CID 8500420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).