1-benzyl-5-nitro-1H-1,3-benzimidazole
TL;DR: 1-benzyl-5-nitro-1H-1,3-benzimidazole (CAS 15207-93-9) is a chemical compound with molecular formula C14H11N3O2 and molecular weight 253.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-5-nitrobenzimidazole
Also Known As: 1-benzyl-5-nitro-1H-1,3-benzimidazole, 1-benzyl-5-nitrobenzimidazole, Benzhydrylidenefluorene, benzylnitrobenzimidazole, 1-benzyl-5-nitro-1H-benzimidazole
Technical Specifications
| Molecular Formula | C14H11N3O2 |
| Molecular Weight | 253.08513 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.08513 Da |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
| SMILES | C1=CC=C(C=C1)CN2C=NC3=C2C=CC(=C3)[N+](=O)[O-] |
| InChIKey | IMWRCUGAWHFPPC-UHFFFAOYSA-N |
Chemical Property Profile of 1-benzyl-5-nitro-1H-1,3-benzimidazole
Property Insights of 1-benzyl-5-nitro-1H-1,3-benzimidazole
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-5-nitro-1H-1,3-benzimidazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-5-nitro-1H-1,3-benzimidazole. Following Lipinski's Rule of Five, 1-benzyl-5-nitro-1H-1,3-benzimidazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-benzyl-5-nitro-1H-1,3-benzimidazole?
The CAS number of 1-benzyl-5-nitro-1H-1,3-benzimidazole is 15207-93-9.
What is the molecular formula of 1-benzyl-5-nitro-1H-1,3-benzimidazole?
The molecular formula of 1-benzyl-5-nitro-1H-1,3-benzimidazole is C14H11N3O2.
What is the molecular weight of 1-benzyl-5-nitro-1H-1,3-benzimidazole?
The molecular weight of 1-benzyl-5-nitro-1H-1,3-benzimidazole is 253.08513 g/mol.
Where can I buy 1-benzyl-5-nitro-1H-1,3-benzimidazole?
You can request a quote for 1-benzyl-5-nitro-1H-1,3-benzimidazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-benzyl-5-nitro-1H-1,3-benzimidazole?
Yes, CoreyChem provides custom synthesis services for 1-benzyl-5-nitro-1H-1,3-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.