Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate
TL;DR: Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate (CAS 69766-44-5) is a chemical compound with molecular formula C15H23ClN4O3 and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-2-(3-piperidin-1-ylpropyl)-1H-benzimidazole;hydrate;hydrochloride
Also Known As: Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate, 5-Nitro-2-(3-(piperidino)propyl)benzimidazole hydrochloride hydrate, 6-Nitro-2-[3-(1-piperidinyl)propyl]-1H-benzimidazole hydrochloride hydrate, 6-nitro-2-(3-piperidin-1-ylpropyl)-1H-benzimidazole hydrate hydrochloride, 6-Nitro-2-[3-(piperidin-1-yl)propyl]-1H-1,3-benzimidazole--hydrogen chloride--water (1/1/1)
| Molecular Formula | C15H23ClN4O3 |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 2.4867 |
| Topological Polar Surface Area | 106.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.14587 |
| Heavy Atoms | 23 |
| Complexity | 640.6837 |
Chemical Identifiers
| CAS Number | 69766-44-5 |
|---|---|
| SMILES | C1CCN(CC1)CCCC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-].O.Cl |
Product Overview
Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate (CAS 69766-44-5), with molecular formula C15H23ClN4O3 and molecular weight 342.15 g/mol. IUPAC: 6-nitro-2-(3-piperidin-1-ylpropyl)-1H-benzimidazole;hydrate;hydrochloride.
Chemical Property Profile of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate
Property Insights of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate
The XLogP value of 2.4867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate. The TPSA of 106.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate. Following Lipinski's Rule of Five, Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate?
The CAS number of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate is 69766-44-5.
What is the molecular formula of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate?
The molecular formula of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate is C15H23ClN4O3.
What is the molecular weight of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate?
The molecular weight of Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate is 342.15 g/mol.
Where can I buy Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate?
You can request a quote for Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 5-nitro-2-(3-piperidinopropyl)-, hydrochloride, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.