N-phenyloctanethioamide
TL;DR: N-phenyloctanethioamide (CAS 163313-57-3) is a chemical compound with molecular formula C14H21NS and molecular weight 235.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyloctanethioamide
Also Known As: N-phenyloctanethioamide
| Molecular Formula | C14H21NS |
|---|---|
| Molecular Weight | 235.14 g/mol |
| LogP | 4.7864 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 235.13947 |
| Heavy Atoms | 16 |
| Complexity | 294.86346 |
Chemical Identifiers
| CAS Number | 163313-57-3 |
|---|---|
| SMILES | CCCCCCCC(=S)NC1=CC=CC=C1 |
Product Overview
N-phenyloctanethioamide (CAS 163313-57-3), with molecular formula C14H21NS and molecular weight 235.14 g/mol. IUPAC: N-phenyloctanethioamide.
Chemical Property Profile of N-phenyloctanethioamide
Property Insights of N-phenyloctanethioamide
The XLogP value of 4.7864 indicates that N-phenyloctanethioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, N-phenyloctanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-phenyloctanethioamide has 1 hydrogen bond donor(s) and 1 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-phenyloctanethioamide?
The CAS number of N-phenyloctanethioamide is 163313-57-3.
What is the molecular formula of N-phenyloctanethioamide?
The molecular formula of N-phenyloctanethioamide is C14H21NS.
What is the molecular weight of N-phenyloctanethioamide?
The molecular weight of N-phenyloctanethioamide is 235.14 g/mol.
Where can I buy N-phenyloctanethioamide?
You can request a quote for N-phenyloctanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-phenyloctanethioamide?
Yes, KEHONG BIO provides custom synthesis services for N-phenyloctanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.