O-Butyl N-phenylcarbamothioate
TL;DR: O-Butyl N-phenylcarbamothioate (CAS 17425-14-8) is a chemical compound with molecular formula C11H15NOS and molecular weight 209.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-butyl N-phenylcarbamothioate
Also Known As: O-Butyl phenylcarbamothioate, Butyl phenylaminothioformate, O-butyl N-phenylcarbamothioate, N-phenylbutoxycarbothioamide, Carbamothioic acid, phenyl-, O-butyl ester
| Molecular Formula | C11H15NOS |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 3.2001 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.08743 |
| Heavy Atoms | 14 |
| Complexity | 273.87582 |
Chemical Identifiers
| CAS Number | 17425-14-8 |
|---|---|
| SMILES | CCCCOC(=S)NC1=CC=CC=C1 |
Product Overview
O-Butyl N-phenylcarbamothioate (CAS 17425-14-8), with molecular formula C11H15NOS and molecular weight 209.09 g/mol. IUPAC: O-butyl N-phenylcarbamothioate.
Chemical Property Profile of O-Butyl N-phenylcarbamothioate
Property Insights of O-Butyl N-phenylcarbamothioate
The XLogP value of 3.2001 indicates that O-Butyl N-phenylcarbamothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, O-Butyl N-phenylcarbamothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Butyl N-phenylcarbamothioate has 1 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 O-Butyl N-phenylcarbamothioate?
The CAS number of O-Butyl N-phenylcarbamothioate is 17425-14-8.
What is the molecular formula of O-Butyl N-phenylcarbamothioate?
The molecular formula of O-Butyl N-phenylcarbamothioate is C11H15NOS.
What is the molecular weight of O-Butyl N-phenylcarbamothioate?
The molecular weight of O-Butyl N-phenylcarbamothioate is 209.09 g/mol.
Where can I buy O-Butyl N-phenylcarbamothioate?
You can request a quote for O-Butyl N-phenylcarbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Butyl N-phenylcarbamothioate?
Yes, KEHONG BIO provides custom synthesis services for O-Butyl N-phenylcarbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.