Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)
TL;DR: Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) (CAS 22270-63-9) is a chemical compound with molecular formula C16H21N3O5 and molecular weight 335.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3H-benzimidazol-1-ium-1-yl)ethyl]-3-methylbutanamide;2-hydroxy-2-oxoacetate
Also Known As: N-(2-(1-Benzimidazolyl)ethyl)-3-methyl-butyramide oxalate, BUTYRAMIDE, N-(2-(1-BENZIMIDAZOLYL)ETHYL)-3-METHYL-, OXALATE (1:1), N-[2-(3H-benzimidazol-1-ium-1-yl)ethyl]-3-methylbutanamide; 2-hydroxy-2-oxoacetate, RefChem:331188
| Molecular Formula | C16H21N3O5 |
|---|---|
| Molecular Weight | 335.15 g/mol |
| LogP | -0.56 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.14813 |
| Heavy Atoms | 24 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 22270-63-9 |
|---|---|
| SMILES | CC(C)CC(=O)NCC[N+]1=CNC2=CC=CC=C21.C(=O)(C(=O)[O-])O |
| InChIKey | DYDDHQPTHPVHRO-UHFFFAOYSA-N |
Product Overview
Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) (CAS 22270-63-9), with molecular formula C16H21N3O5 and molecular weight 335.15 g/mol. IUPAC: N-[2-(3H-benzimidazol-1-ium-1-yl)ethyl]-3-methylbutanamide;2-hydroxy-2-oxoacetate.
Chemical Property Profile of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)
Property Insights of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)
The XLogP value of -0.56 indicates that Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1). Following Lipinski's Rule of Five, Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) has 3 hydrogen bond donor(s) and 5 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 Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)?
The CAS number of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) is 22270-63-9.
What is the molecular formula of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)?
The molecular formula of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) is C16H21N3O5.
What is the molecular weight of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)?
The molecular weight of Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) is 335.15 g/mol.
Where can I buy Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)?
You can request a quote for Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Butyramide, N-(2-(1-benzimidazolyl)ethyl)-3-methyl-, oxalate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.