1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride
TL;DR: 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride (CAS 117651-73-7) is a chemical compound with molecular formula C23H33ClN4O and molecular weight 416.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-adamantyl)-2-(3-butyl-2-iminobenzimidazol-1-yl)acetamide;hydrochloride
Also Known As: 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride, 1H-Benzimidazole-1-acetamide, 2,3-dihydro-3-butyl-2-imino-N-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-, monohydrochloride, N-(2-adamantyl)-2-(3-butyl-2-iminobenzimidazol-1-yl)acetamide hydrochloride, N-(Adamantan-2-yl)(3-butyl-2-imino-2,3-dihydro-1H-1,3-benzimidazol-1-yl)ethanimidic acid--hydrogen chloride (1/1), N-(Adamantan-2-yl)-2-(3-butyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)ethanimidic acid--hydrogen chloride (1/1)
| Molecular Formula | C23H33ClN4O |
|---|---|
| Molecular Weight | 416.23 g/mol |
| LogP | 4.08507 |
| Topological Polar Surface Area | 62.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.23428 |
| Heavy Atoms | 29 |
| Complexity | 917.9912 |
Chemical Identifiers
| CAS Number | 117651-73-7 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2N(C1=N)CC(=O)NC3C4CC5CC(C4)CC3C5.Cl |
Product Overview
1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride (CAS 117651-73-7), with molecular formula C23H33ClN4O and molecular weight 416.23 g/mol. IUPAC: N-(2-adamantyl)-2-(3-butyl-2-iminobenzimidazol-1-yl)acetamide;hydrochloride.
Chemical Property Profile of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride
Property Insights of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride
The XLogP value of 4.08507 indicates that 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride. Following Lipinski's Rule of Five, 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride has 2 hydrogen bond donor(s) and 2 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 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride?
The CAS number of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride is 117651-73-7.
What is the molecular formula of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride?
The molecular formula of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride is C23H33ClN4O.
What is the molecular weight of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride?
The molecular weight of 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride is 416.23 g/mol.
Where can I buy 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride?
You can request a quote for 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyl-2-iminobenzimidazoline-3-acetic acid N-adamaniylamide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.