4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

C25H20ClN3O4S — CID 30388382

IUPAC4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1)c1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C25H20ClN3O4S/c26-24-6-2-1-4-19(24)17-33-22-11-7-18(8-12-22)25(30)28-20-9-13-23(14-10-20)34(31,32)29-21-5-3-15-27-16-21/h1-16,29H,17H2,(H,28,30)
InChIKeyZCHSAXRRFBQMRK-UHFFFAOYSA-N
MW493.97 g/mol
LogP5.37
Rot. Bonds8

About 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (PubChem CID 30388382) has the molecular formula C25H20ClN3O4S and a molecular weight of 493.97 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
PubChem CID30388382
Molecular FormulaC25H20ClN3O4S
Molecular Weight493.97 g/mol
Exact Mass493.09
IUPAC Name4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1)c1ccc(OCc2ccccc2Cl)cc1
InChIInChI=1S/C25H20ClN3O4S/c26-24-6-2-1-4-19(24)17-33-22-11-7-18(8-12-22)25(30)28-20-9-13-23(14-10-20)34(31,32)29-21-5-3-15-27-16-21/h1-16,29H,17H2,(H,28,30)
InChIKeyZCHSAXRRFBQMRK-UHFFFAOYSA-N
XLogP5.37
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500493.97
LogP ≤ 55.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(2-chlorophenyl)methyl-methylsulfonylamino]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 99941660
4-[(2-chlorophenyl)methoxy]-N-phenylbenzamide
CID 8813243
4-[(2-chlorophenyl)methoxy]-N-(4-phenoxyphenyl)benzamide
CID 19916426
5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 43904807
4-ethoxy-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 4948543
N-[4-[(2R)-butan-2-yl]phenyl]-4-[(2-chlorophenyl)methoxy]benzamide
CID 8814272
4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide
CID 8813273
N-(3-bromophenyl)-4-[(2-chlorophenyl)methoxy]benzamide
CID 19916424
4-[(2-chlorophenyl)methoxy]-N-(3,5-dimethylphenyl)benzamide
CID 8813300
4-(4-chlorophenyl)sulfonyl-N-pyridin-3-ylbenzamide
CID 1117984
2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 92646313
2,6-dimethoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 28578712

Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (CID 30388382) is 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1)c1ccc(OCc2ccccc2Cl)cc1.
What is the InChIKey of 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The InChIKey is ZCHSAXRRFBQMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20ClN3O4S/c26-24-6-2-1-4-19(24)17-33-22-11-7-18(8-12-22)25(30)28-20-9-13-23(14-10-20)34(31,32)29-21-5-3-15-27-16-21/h1-16,29H,17H2,(H,28,30).
What are the key properties of 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide has a molecular weight of 493.97 g/mol, XLogP of 5.37, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)methoxy]-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 30388382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).