Benzyl carbamimidothioate;heptanoic acid
TL;DR: Benzyl carbamimidothioate;heptanoic acid (CAS 2151-66-8) is a chemical compound with molecular formula C15H24N2O2S and molecular weight 296.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl carbamimidothioate;heptanoic acid
Also Known As: benzyl carbamimidothioate,heptanoic acid, Benzyl carbamimidothioate;heptanoic acid, benzyl carbamimidothioate; heptanoic acid, Heptanoic acid--benzyl carbamimidothioate (1/1)
| Molecular Formula | C15H24N2O2S |
|---|---|
| Molecular Weight | 296.16 g/mol |
| LogP | 3.85467 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.15585 |
| Heavy Atoms | 20 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 2151-66-8 |
|---|---|
| SMILES | CCCCCCC(=O)O.C1=CC=C(C=C1)CSC(=N)N |
| InChIKey | BCDYYEVYAMJRBL-UHFFFAOYSA-N |
Product Overview
Benzyl carbamimidothioate;heptanoic acid (CAS 2151-66-8), with molecular formula C15H24N2O2S and molecular weight 296.16 g/mol. IUPAC: benzyl carbamimidothioate;heptanoic acid.
Chemical Property Profile of Benzyl carbamimidothioate;heptanoic acid
Property Insights of Benzyl carbamimidothioate;heptanoic acid
The XLogP value of 3.85467 indicates that Benzyl carbamimidothioate;heptanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl carbamimidothioate;heptanoic acid. Following Lipinski's Rule of Five, Benzyl carbamimidothioate;heptanoic acid has 3 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 Benzyl carbamimidothioate;heptanoic acid?
The CAS number of Benzyl carbamimidothioate;heptanoic acid is 2151-66-8.
What is the molecular formula of Benzyl carbamimidothioate;heptanoic acid?
The molecular formula of Benzyl carbamimidothioate;heptanoic acid is C15H24N2O2S.
What is the molecular weight of Benzyl carbamimidothioate;heptanoic acid?
The molecular weight of Benzyl carbamimidothioate;heptanoic acid is 296.16 g/mol.
Where can I buy Benzyl carbamimidothioate;heptanoic acid?
You can request a quote for Benzyl carbamimidothioate;heptanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl carbamimidothioate;heptanoic acid?
Yes, KEHONG BIO provides custom synthesis services for Benzyl carbamimidothioate;heptanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.