methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate

C15H15NO5S — CID 110757322

IUPACmethyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate
SMILESCOC(=O)c1ccccc1NS(=O)(=O)c1ccccc1OC
InChIInChI=1S/C15H15NO5S/c1-20-13-9-5-6-10-14(13)22(18,19)16-12-8-4-3-7-11(12)15(17)21-2/h3-10,16H,1-2H3
InChIKeyYGXFLCAGEYIAGP-UHFFFAOYSA-N
MW321.35 g/mol
LogP2.28
Rot. Bonds5

About methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate

methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate (PubChem CID 110757322) has the molecular formula C15H15NO5S and a molecular weight of 321.35 g/mol. Its IUPAC name is methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate.

Molecular Properties

Compound Namemethyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate
PubChem CID110757322
Molecular FormulaC15H15NO5S
Molecular Weight321.35 g/mol
Exact Mass321.07
IUPAC Namemethyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate
SMILESCOC(=O)c1ccccc1NS(=O)(=O)c1ccccc1OC
InChIInChI=1S/C15H15NO5S/c1-20-13-9-5-6-10-14(13)22(18,19)16-12-8-4-3-7-11(12)15(17)21-2/h3-10,16H,1-2H3
InChIKeyYGXFLCAGEYIAGP-UHFFFAOYSA-N
XLogP2.28
TPSA81.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.35
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-methoxyphenyl)sulfonylamino]benzoic acid
CID 43091453
methyl 2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]benzoate
CID 27242666
3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
CID 86983204
2-[(2-methoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 51170213
N-(2-bromophenyl)-2-methoxybenzenesulfonamide
CID 47104314
methyl 2-[(2-methoxy-5-methylphenyl)sulfamoyl]benzoate
CID 7939248
methyl 2-[(2-chloro-3-pyridinyl)sulfonylamino]benzoate
CID 43422913
methyl 2-[(2-methoxycarbonylphenyl)sulfamoylmethylsulfonylamino]benzoate
CID 91721090
methyl 2-[(4-iodophenyl)sulfonylamino]benzoate
CID 43423372
3-[(2-methoxycarbonylphenyl)sulfamoyl]-4-methylbenzoic acid
CID 24502065
ethyl 2-[(2-methoxy-5-methylphenyl)sulfonylamino]benzoate
CID 95969690
N-(2-fluoro-3-hydroxyphenyl)-2-methoxybenzenesulfonamide
CID 138995627

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate?
The IUPAC name of methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate (CID 110757322) is methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate.
What is the SMILES notation for methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate?
The canonical SMILES for methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate is COC(=O)c1ccccc1NS(=O)(=O)c1ccccc1OC.
What is the InChIKey of methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate?
The InChIKey is YGXFLCAGEYIAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO5S/c1-20-13-9-5-6-10-14(13)22(18,19)16-12-8-4-3-7-11(12)15(17)21-2/h3-10,16H,1-2H3.
What are the key properties of methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate?
methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate has a molecular weight of 321.35 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate is sourced from PubChem (CID 110757322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).