4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide

C22H17N3O4S — CID 19258755

IUPAC4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide
SMILESNC(=O)c1ccc(NS(=O)(=O)c2ccc(-c3ncc(-c4ccccc4)o3)cc2)cc1
InChIInChI=1S/C22H17N3O4S/c23-21(26)16-6-10-18(11-7-16)25-30(27,28)19-12-8-17(9-13-19)22-24-14-20(29-22)15-4-2-1-3-5-15/h1-14,25H,(H2,23,26)
InChIKeyDNJZGVRTISETBC-UHFFFAOYSA-N
MW419.46 g/mol
LogP3.91
Rot. Bonds6

About 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide

4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide (PubChem CID 19258755) has the molecular formula C22H17N3O4S and a molecular weight of 419.46 g/mol. Its IUPAC name is 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide.

Molecular Properties

Compound Name4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide
PubChem CID19258755
Molecular FormulaC22H17N3O4S
Molecular Weight419.46 g/mol
Exact Mass419.09
IUPAC Name4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide
SMILESNC(=O)c1ccc(NS(=O)(=O)c2ccc(-c3ncc(-c4ccccc4)o3)cc2)cc1
InChIInChI=1S/C22H17N3O4S/c23-21(26)16-6-10-18(11-7-16)25-30(27,28)19-12-8-17(9-13-19)22-24-14-20(29-22)15-4-2-1-3-5-15/h1-14,25H,(H2,23,26)
InChIKeyDNJZGVRTISETBC-UHFFFAOYSA-N
XLogP3.91
TPSA115.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.46
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(methylsulfamoyl)phenyl]-4-(5-phenyl-1,3-oxazol-2-yl)benzenesulfonamide
CID 19258675
2-methylpropyl 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzoate
CID 19258628
4-(5-phenyl-1,3-oxazol-2-yl)-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
CID 19258749
N-(5-iodo-2-pyridinyl)-4-(5-phenyl-1,3-oxazol-2-yl)benzenesulfonamide
CID 19258782
[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl 4-(phenylsulfamoyl)benzoate
CID 16595735
N-(4-hydroxy-2-methylphenyl)-4-(5-phenyl-1,3-oxazol-2-yl)benzenesulfonamide
CID 19258754
4-[(4-methylphenyl)sulfonylamino]benzamide
CID 837332
methyl 2-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]-1,3-benzothiazole-6-carboxylate
CID 19258840
2,2-dimethyl-N-[4-[[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]sulfonylamino]phenyl]propanamide
CID 21060679
4-[(4-chlorophenyl)sulfamoyl]benzamide
CID 27187051
4-[(4-fluorophenyl)sulfamoyl]benzamide
CID 2098781
4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide
CID 103775704

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide?
The IUPAC name of 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide (CID 19258755) is 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide.
What is the SMILES notation for 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide?
The canonical SMILES for 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide is NC(=O)c1ccc(NS(=O)(=O)c2ccc(-c3ncc(-c4ccccc4)o3)cc2)cc1.
What is the InChIKey of 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide?
The InChIKey is DNJZGVRTISETBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O4S/c23-21(26)16-6-10-18(11-7-16)25-30(27,28)19-12-8-17(9-13-19)22-24-14-20(29-22)15-4-2-1-3-5-15/h1-14,25H,(H2,23,26).
What are the key properties of 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide?
4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide has a molecular weight of 419.46 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 19258755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).