4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide

C14H12F2N2O4S — CID 46644155

IUPAC4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)Nc2ccc(OC(F)F)cc2)cc1
InChIInChI=1S/C14H12F2N2O4S/c15-14(16)22-11-5-3-10(4-6-11)18-23(20,21)12-7-1-9(2-8-12)13(17)19/h1-8,14,18H,(H2,17,19)
InChIKeyCCUYHTGGNOUMSK-UHFFFAOYSA-N
MW342.32 g/mol
LogP2.19
Rot. Bonds6

About 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide

4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide (PubChem CID 46644155) has the molecular formula C14H12F2N2O4S and a molecular weight of 342.32 g/mol. Its IUPAC name is 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide
PubChem CID46644155
Molecular FormulaC14H12F2N2O4S
Molecular Weight342.32 g/mol
Exact Mass342.05
IUPAC Name4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)Nc2ccc(OC(F)F)cc2)cc1
InChIInChI=1S/C14H12F2N2O4S/c15-14(16)22-11-5-3-10(4-6-11)18-23(20,21)12-7-1-9(2-8-12)13(17)19/h1-8,14,18H,(H2,17,19)
InChIKeyCCUYHTGGNOUMSK-UHFFFAOYSA-N
XLogP2.19
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.32
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-fluorophenyl)sulfamoyl]benzamide
CID 2098781
4-[(4-chlorophenyl)sulfamoyl]benzamide
CID 27187051
4-[(4-methylphenyl)sulfonylamino]benzamide
CID 837332
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
N-[(E)-[4-(difluoromethoxy)phenyl]methylideneamino]-4-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 6900782
N-[4-(difluoromethoxy)phenyl]-3,4-difluorobenzenesulfonamide
CID 8504738
4-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]benzamide
CID 26027108
4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide
CID 103775704
4-[(3-amino-4-fluorophenyl)sulfamoyl]benzamide
CID 43604881
4-[[6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]sulfamoyl]benzamide
CID 86870489
4-[[4-[(2-methoxyacetyl)amino]phenyl]sulfamoyl]benzamide
CID 30805411
N-[4-(difluoromethoxy)phenyl]-4-(ethylsulfamoyl)benzamide
CID 9405047

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide?
The IUPAC name of 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide (CID 46644155) is 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide.
What is the SMILES notation for 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide?
The canonical SMILES for 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)Nc2ccc(OC(F)F)cc2)cc1.
What is the InChIKey of 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide?
The InChIKey is CCUYHTGGNOUMSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O4S/c15-14(16)22-11-5-3-10(4-6-11)18-23(20,21)12-7-1-9(2-8-12)13(17)19/h1-8,14,18H,(H2,17,19).
What are the key properties of 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide?
4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide has a molecular weight of 342.32 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide is sourced from PubChem (CID 46644155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).