N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide

C18H14F2N2O4S2 — CID 37311988

IUPACN-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide
SMILESO=C(Nc1ccccc1OC(F)F)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C18H14F2N2O4S2/c19-18(20)26-15-5-2-1-4-14(15)21-17(23)12-7-9-13(10-8-12)22-28(24,25)16-6-3-11-27-16/h1-11,18,22H,(H,21,23)
InChIKeyIBVILAIRGNDGQS-UHFFFAOYSA-N
MW424.45 g/mol
LogP4.40
Rot. Bonds7

About N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide

N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide (PubChem CID 37311988) has the molecular formula C18H14F2N2O4S2 and a molecular weight of 424.45 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide
PubChem CID37311988
Molecular FormulaC18H14F2N2O4S2
Molecular Weight424.45 g/mol
Exact Mass424.04
IUPAC NameN-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide
SMILESO=C(Nc1ccccc1OC(F)F)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C18H14F2N2O4S2/c19-18(20)26-15-5-2-1-4-14(15)21-17(23)12-7-9-13(10-8-12)22-28(24,25)16-6-3-11-27-16/h1-11,18,22H,(H,21,23)
InChIKeyIBVILAIRGNDGQS-UHFFFAOYSA-N
XLogP4.40
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.45
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(difluoromethoxy)phenyl]-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 37312010
methyl 2-hydroxy-3-[[4-(thiophen-2-ylsulfonylamino)benzoyl]amino]benzoate
CID 56543247
N-[(E)-1-[4-(difluoromethoxy)phenyl]propylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 6177739
N-[2-(difluoromethoxy)phenyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 2353818
N-[2-(2-methylpropoxy)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55989925
N-[(2-methoxyphenyl)methyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 15997618
N-[3-chloro-4-(difluoromethoxy)phenyl]-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 46576758
N-[4-(3-methylbutanoylamino)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 33026888
N-[2-(difluoromethoxy)-5-methylphenyl]thiophene-2-sulfonamide
CID 19684078
N-ethoxy-4-(thiophen-2-ylsulfonylamino)benzamide
CID 17470879
methyl 2-[[4-(thiophen-2-ylsulfonylamino)benzoyl]amino]acetate
CID 8840841
4-butoxy-N-[2-(thiophen-2-ylsulfonylamino)phenyl]benzamide
CID 30885606

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide (CID 37311988) is N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide is O=C(Nc1ccccc1OC(F)F)c1ccc(NS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide?
The InChIKey is IBVILAIRGNDGQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2O4S2/c19-18(20)26-15-5-2-1-4-14(15)21-17(23)12-7-9-13(10-8-12)22-28(24,25)16-6-3-11-27-16/h1-11,18,22H,(H,21,23).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide?
N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide has a molecular weight of 424.45 g/mol, XLogP of 4.40, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-4-(thiophen-2-ylsulfonylamino)benzamide is sourced from PubChem (CID 37311988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).