TL;DR: N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide (CAS 117536-14-8) is a chemical compound with molecular formula C13H11N3O4 and molecular weight 273.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-1-(5-nitrofuran-2-yl)ethylideneamino]benzamide
Also Known As: N/'-(1-{5-Nitro-2-furyl}, BAS 00405235, N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide, N'-[1-(5-nitro-2-furyl)ethylidene]benzohydrazide, N-[(E)-1-(5-nitrofuran-2-yl)ethylideneamino]benzamide
| Molecular Formula | C13H11N3O4 |
| Molecular Weight | 273.07495 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.07495 Da |
| Heavy Atoms | 20 |
| Complexity | 399.0 |
| SMILES | C/C(=N\NC(=O)C1=CC=CC=C1)/C2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | RGDWDTAFIRYAGA-NTEUORMPSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide. Following Lipinski's Rule of Five, N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide is 117536-14-8.
The molecular formula of N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide is C13H11N3O4.
The molecular weight of N'-(1-{5-nitro-2-furyl}ethylidene)benzohydrazide is 273.07495 g/mol.
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