1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone
TL;DR: 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone (CAS 297178-87-1) is a chemical compound with molecular formula C12H7N3O4 and molecular weight 257.04367 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzimidazol-1-yl-(5-nitrofuran-2-yl)methanone
Also Known As: benzimidazolyl 5-nitro(2-furyl) ketone, 1-(5-nitro-2-furoyl)-1H-benzimidazole, 1-{5-nitro-2-furoyl}-1H-benzimidazole, 1H-Benzimidazol-1-yl(5-nitro-2-furanyl)methanone, 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone
Technical Specifications
| Molecular Formula | C12H7N3O4 |
| Molecular Weight | 257.04367 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 93.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.04367 Da |
| Heavy Atoms | 19 |
| Complexity | 384.0 |
| SMILES | C1=CC=C2C(=C1)N=CN2C(=O)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | PEAGYYWBJBZYKU-UHFFFAOYSA-N |
Chemical Property Profile of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone
Property Insights of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone. Following Lipinski's Rule of Five, 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone?
The CAS number of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone is 297178-87-1.
What is the molecular formula of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone?
The molecular formula of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone is C12H7N3O4.
What is the molecular weight of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone?
The molecular weight of 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone is 257.04367 g/mol.
Where can I buy 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone?
You can request a quote for 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone?
Yes, CoreyChem provides custom synthesis services for 1H-benzimidazol-1-yl(5-nitrofuran-2-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.