About N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide
N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide (PubChem CID 11270007) has the molecular formula C24H20N2O3S
and a molecular weight of 416.50 g/mol. Its IUPAC name is N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide.
Molecular Properties
| Compound Name | N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide |
| PubChem CID | 11270007 |
| Molecular Formula | C24H20N2O3S |
| Molecular Weight | 416.50 g/mol |
| Exact Mass | 416.12 |
| IUPAC Name | N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide |
| SMILES | O=C(Nc1ccc(S(=O)(=O)NCc2ccccc2)c2ccccc12)c1ccccc1 |
| InChI | InChI=1S/C24H20N2O3S/c27-24(19-11-5-2-6-12-19)26-22-15-16-23(21-14-8-7-13-20(21)22)30(28,29)25-17-18-9-3-1-4-10-18/h1-16,25H,17H2,(H,26,27) |
| InChIKey | QPJKMKVTEJYYGG-UHFFFAOYSA-N |
| XLogP | 4.57 |
| TPSA | 75.27 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 416.50 |
| LogP ≤ 5 | 4.57 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide?
The IUPAC name of N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide (CID 11270007) is N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide.
What is the SMILES notation for N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide?
The canonical SMILES for N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide is O=C(Nc1ccc(S(=O)(=O)NCc2ccccc2)c2ccccc12)c1ccccc1.
What is the InChIKey of N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide?
The InChIKey is QPJKMKVTEJYYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3S/c27-24(19-11-5-2-6-12-19)26-22-15-16-23(21-14-8-7-13-20(21)22)30(28,29)25-17-18-9-3-1-4-10-18/h1-16,25H,17H2,(H,26,27).
What are the key properties of N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide?
N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide has a molecular weight of 416.50 g/mol, XLogP of 4.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzylsulfamoyl)naphthalen-1-yl]benzamide is sourced from PubChem (CID 11270007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).