N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide

C21H19ClN2O5S — CID 24514729

IUPACN-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2Cl)cc1NC(C)=O
InChIInChI=1S/C21H19ClN2O5S/c1-14(25)23-18-13-15(11-12-20(18)28-2)30(26,27)24-17-8-4-6-10-21(17)29-19-9-5-3-7-16(19)22/h3-13,24H,1-2H3,(H,23,25)
InChIKeyRQIBHSFGRMWVQV-UHFFFAOYSA-N
MW446.91 g/mol
LogP4.90
Rot. Bonds7

About N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide

N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide (PubChem CID 24514729) has the molecular formula C21H19ClN2O5S and a molecular weight of 446.91 g/mol. Its IUPAC name is N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
PubChem CID24514729
Molecular FormulaC21H19ClN2O5S
Molecular Weight446.91 g/mol
Exact Mass446.07
IUPAC NameN-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2Cl)cc1NC(C)=O
InChIInChI=1S/C21H19ClN2O5S/c1-14(25)23-18-13-15(11-12-20(18)28-2)30(26,27)24-17-8-4-6-10-21(17)29-19-9-5-3-7-16(19)22/h3-13,24H,1-2H3,(H,23,25)
InChIKeyRQIBHSFGRMWVQV-UHFFFAOYSA-N
XLogP4.90
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.91
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-methoxy-5-[(2-phenoxyphenyl)sulfamoyl]phenyl]acetamide
CID 71903158
N-[5-[(2-chloro-4-fluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 7514301
N-[5-[[2-(4-ethoxyphenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 17426332
3-chloro-4-methoxy-N-(2-methoxyphenyl)benzenesulfonamide
CID 961849
N-[2-chloro-4-[(5-chloro-2-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 25042468
N-[2-methoxy-5-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 7343262
ethyl 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]benzoate
CID 26969690
2-chloro-N-[2-fluoro-4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 18892974
3-(3,5-dimethylpyrazolidin-4-yl)-N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]propanamide
CID 73253290
N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]naphthalene-2-carboxamide
CID 24635874
4-N-[2-(2-chlorophenoxy)phenyl]benzene-1,4-disulfonamide
CID 26781676
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
CID 71903202

Frequently Asked Questions

What is the IUPAC name of N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide?
The IUPAC name of N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide (CID 24514729) is N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide.
What is the SMILES notation for N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide?
The canonical SMILES for N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide is COc1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2Cl)cc1NC(C)=O.
What is the InChIKey of N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide?
The InChIKey is RQIBHSFGRMWVQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O5S/c1-14(25)23-18-13-15(11-12-20(18)28-2)30(26,27)24-17-8-4-6-10-21(17)29-19-9-5-3-7-16(19)22/h3-13,24H,1-2H3,(H,23,25).
What are the key properties of N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide?
N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide has a molecular weight of 446.91 g/mol, XLogP of 4.90, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide is sourced from PubChem (CID 24514729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).