N-benzyl-N'-butylethanediamide
TL;DR: N-benzyl-N'-butylethanediamide (CAS 428830-58-4) is a chemical compound with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-benzyl-N-butyloxamide
Also Known As: N'-benzyl-N-butyloxamide, N-benzyl-N'-butylethanediamide, AB00109318-01
| Molecular Formula | C13H18N2O2 |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 1.2191 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.13683 |
| Heavy Atoms | 17 |
| Complexity | 362.94202 |
Chemical Identifiers
| CAS Number | 428830-58-4 |
|---|---|
| SMILES | CCCCNC(=O)C(=O)NCC1=CC=CC=C1 |
Product Overview
N-benzyl-N'-butylethanediamide (CAS 428830-58-4), with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol. IUPAC: N'-benzyl-N-butyloxamide.
Chemical Property Profile of N-benzyl-N'-butylethanediamide
Property Insights of N-benzyl-N'-butylethanediamide
The XLogP value of 1.2191 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-N'-butylethanediamide. With a topological polar surface area (TPSA) of 58.2 Ų, N-benzyl-N'-butylethanediamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-N'-butylethanediamide 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 N-benzyl-N'-butylethanediamide?
The CAS number of N-benzyl-N'-butylethanediamide is 428830-58-4.
What is the molecular formula of N-benzyl-N'-butylethanediamide?
The molecular formula of N-benzyl-N'-butylethanediamide is C13H18N2O2.
What is the molecular weight of N-benzyl-N'-butylethanediamide?
The molecular weight of N-benzyl-N'-butylethanediamide is 234.14 g/mol.
Where can I buy N-benzyl-N'-butylethanediamide?
You can request a quote for N-benzyl-N'-butylethanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-N'-butylethanediamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-N'-butylethanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.