5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide

C20H23ClN2O4S — CID 8615574

IUPAC5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C20H23ClN2O4S/c1-27-19-12-9-16(21)13-18(19)20(24)22-23-28(25,26)17-10-7-15(8-11-17)14-5-3-2-4-6-14/h7-14,23H,2-6H2,1H3,(H,22,24)
InChIKeyZLMGPLBFSUZOFZ-UHFFFAOYSA-N
MW422.93 g/mol
LogP4.02
Rot. Bonds6

About 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide

5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide (PubChem CID 8615574) has the molecular formula C20H23ClN2O4S and a molecular weight of 422.93 g/mol. Its IUPAC name is 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide.

Molecular Properties

Compound Name5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide
PubChem CID8615574
Molecular FormulaC20H23ClN2O4S
Molecular Weight422.93 g/mol
Exact Mass422.11
IUPAC Name5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide
SMILESCOc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C20H23ClN2O4S/c1-27-19-12-9-16(21)13-18(19)20(24)22-23-28(25,26)17-10-7-15(8-11-17)14-5-3-2-4-6-14/h7-14,23H,2-6H2,1H3,(H,22,24)
InChIKeyZLMGPLBFSUZOFZ-UHFFFAOYSA-N
XLogP4.02
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.93
LogP ≤ 54.02
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'-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-5-chloro-2-methoxybenzohydrazide
CID 8615539
N'-(4-cyclohexylphenyl)sulfonyl-2,5-dimethylfuran-3-carbohydrazide
CID 26980824
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
4-[[(5-chloro-2-methoxybenzoyl)amino]carbamoyl]-N-propan-2-ylbenzenesulfonamide
CID 24636094
5-chloro-N-(cyclohexylmethyl)-2-methoxybenzamide
CID 2666780
cerium;5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxybenzamide
CID 88767103
(5-chloro-2-methoxyphenyl)-cycloheptylmethanone
CID 65399771
(5-chloro-2-methoxyphenyl)-[3-(4-chlorophenyl)azepan-1-yl]methanone
CID 121146503
2-[2-(4-cyclohexylphenyl)sulfonylhydrazinyl]-2-oxo-N-propan-2-ylacetamide
CID 8841087
4-cyclohexyl-N-(2,4-dimethoxyphenyl)benzenesulfonamide
CID 7940687
5-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methoxybenzamide
CID 94413829
5-chloro-N'-(5-chloro-2-iodobenzoyl)-2-methoxybenzohydrazide
CID 39708070

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide?
The IUPAC name of 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide (CID 8615574) is 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide.
What is the SMILES notation for 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide?
The canonical SMILES for 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide is COc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide?
The InChIKey is ZLMGPLBFSUZOFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O4S/c1-27-19-12-9-16(21)13-18(19)20(24)22-23-28(25,26)17-10-7-15(8-11-17)14-5-3-2-4-6-14/h7-14,23H,2-6H2,1H3,(H,22,24).
What are the key properties of 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide?
5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide has a molecular weight of 422.93 g/mol, XLogP of 4.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N'-(4-cyclohexylphenyl)sulfonyl-2-methoxybenzohydrazide is sourced from PubChem (CID 8615574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).