5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide

C21H20N2O5S — CID 135690835

IUPAC5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(/N=C/c3ccccc3O)ccc2OC)cc1
InChIInChI=1S/C21H20N2O5S/c1-27-18-10-7-16(8-11-18)23-29(25,26)21-13-17(9-12-20(21)28-2)22-14-15-5-3-4-6-19(15)24/h3-14,23-24H,1-2H3/b22-14+
InChIKeyNPCFKWFMWIPPOA-HYARGMPZSA-N
MW412.47 g/mol
LogP3.96
Rot. Bonds7

About 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide

5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide (PubChem CID 135690835) has the molecular formula C21H20N2O5S and a molecular weight of 412.47 g/mol. Its IUPAC name is 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide
PubChem CID135690835
Molecular FormulaC21H20N2O5S
Molecular Weight412.47 g/mol
Exact Mass412.11
IUPAC Name5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(/N=C/c3ccccc3O)ccc2OC)cc1
InChIInChI=1S/C21H20N2O5S/c1-27-18-10-7-16(8-11-18)23-29(25,26)21-13-17(9-12-20(21)28-2)22-14-15-5-3-4-6-19(15)24/h3-14,23-24H,1-2H3/b22-14+
InChIKeyNPCFKWFMWIPPOA-HYARGMPZSA-N
XLogP3.96
TPSA97.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.47
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(2-hydroxy-5-methoxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4850531
2-chloro-5-[(2-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)benzenesulfonamide
CID 135690830
4-methoxy-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-disulfonamide
CID 3106646
2-[(3-chloro-4-methoxyphenyl)iminomethyl]phenol
CID 964874
2-[2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-N-(4-methoxyphenyl)-5-nitrobenzenesulfonamide
CID 3400997
N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]-2,5-dimethoxybenzenesulfonamide
CID 135647812
2,4-dimethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 22774026
2,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzenesulfonamide
CID 2208419
2,5-dimethoxy-N-[(E)-(2-methylphenyl)methylideneamino]benzenesulfonamide
CID 110516616
3-fluoro-N-[4-methoxy-3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 26851586
2,5-dimethoxy-N-[4-(sulfamoylmethyl)phenyl]benzenesulfonamide
CID 24662891
1-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenyl]-3-methylurea
CID 46518710

Frequently Asked Questions

What is the IUPAC name of 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide?
The IUPAC name of 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide (CID 135690835) is 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide?
The canonical SMILES for 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide is COc1ccc(NS(=O)(=O)c2cc(/N=C/c3ccccc3O)ccc2OC)cc1.
What is the InChIKey of 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide?
The InChIKey is NPCFKWFMWIPPOA-HYARGMPZSA-N. The full InChI is InChI=1S/C21H20N2O5S/c1-27-18-10-7-16(8-11-18)23-29(25,26)21-13-17(9-12-20(21)28-2)22-14-15-5-3-4-6-19(15)24/h3-14,23-24H,1-2H3/b22-14+.
What are the key properties of 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide?
5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide has a molecular weight of 412.47 g/mol, XLogP of 3.96, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-hydroxyphenyl)methylideneamino]-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 135690835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).