HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-butoxy-N'-(1,2-dihydronaphtho[2,1-b]furan-2-ylcarbonyl)benzenesulfonohydrazide
N'-(4-butoxybenzenesulfonyl)-1H,2H-naphtho[2,1-b]furan-2-carbohydrazide · 4-BUTOXY-N'-(1,2-DIHYDRONAPHTHO[2,1-B]FURAN-2-YLCARBONYL)BENZENESULFONOHYDRAZIDE · Naphtho[2,1-b]furan-2-carboxylic acid, 1,2-dihydro-, 2-[(4-butoxyphenyl)sulfonyl]hydrazide
![4-butoxy-N'-(1,2-dihydronaphtho[2,1-b]furan-2-ylcarbonyl)benzenesulfonohydrazide molecular structure](/img/chemical/178717543.png)
Identifiers & Physical Properties
| CAS No. | 478064-30-1 |
|---|---|
| Molecular formula | C23H24N2O5S |
| Average molar mass | 440.5 g/mol |
| Monoisotopic mass | 440.14059304 g/mol |
| SMILES | CCCCOc1ccc(S(=O)(=O)NNC(=O)C2Cc3c(ccc4ccccc34)O2)cc1 |
| InChIKey | QKCZUNBKSLMPIY-UHFFFAOYSA-N |
| PubChem CID | 3536849 |
| ChEMBL | CHEMBL1602046 |
Chemical & Physical Properties
| XLogP | 4.6 |
|---|---|
| Topological polar surface area | 102 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 8 |
| Heavy atoms | 31 |
| Formal charge | 0 |
| Complexity | 701 |
| Density | 1.312±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 7.22±0.25(Predicted) |