N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide
TL;DR: N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide (CAS 733799-77-4) is a chemical compound with molecular formula C16H26N2O2S and molecular weight 310.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-heptan-2-yl-N-(thiophen-2-ylmethyl)butanediamide
Also Known As: N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide, N'-heptan-2-yl-N-(thiophen-2-ylmethyl)butanediamide
| Molecular Formula | C16H26N2O2S |
|---|---|
| Molecular Weight | 310.17 g/mol |
| LogP | 3.2295 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 310.1715 |
| Heavy Atoms | 21 |
| Complexity | 417.9213 |
Chemical Identifiers
| CAS Number | 733799-77-4 |
|---|---|
| SMILES | CCCCCC(C)NC(=O)CCC(=O)NCC1=CC=CS1 |
Product Overview
N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide (CAS 733799-77-4), with molecular formula C16H26N2O2S and molecular weight 310.17 g/mol. IUPAC: N'-heptan-2-yl-N-(thiophen-2-ylmethyl)butanediamide.
Chemical Property Profile of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide
Property Insights of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide
The XLogP value of 3.2295 indicates that N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide has 2 hydrogen bond donor(s) and 3 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-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide?
The CAS number of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide is 733799-77-4.
What is the molecular formula of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide?
The molecular formula of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide is C16H26N2O2S.
What is the molecular weight of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide?
The molecular weight of N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide is 310.17 g/mol.
Where can I buy N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide?
You can request a quote for N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide?
Yes, KEHONG BIO provides custom synthesis services for N-(heptan-2-yl)-N'-(thiophen-2-ylmethyl)butanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.