O-nonan-2-yl Propylaminomethanethioate
TL;DR: O-nonan-2-yl Propylaminomethanethioate (CAS 92411-99-9) is a chemical compound with molecular formula C13H27NOS and molecular weight 245.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-nonan-2-yl N-propylcarbamothioate
Also Known As: O-nonan-2-yl Propylaminomethanethioate, O-nonan-2-yl N-propylcarbamothioate, O-Nonan-2-yl hydrogen propylcarbonimidothioate, O-(Nonan-2-yl) hydrogen propylcarbonimidothioate
| Molecular Formula | C13H27NOS |
|---|---|
| Molecular Weight | 245.18 g/mol |
| LogP | 4.0365 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 245.18134 |
| Heavy Atoms | 16 |
| Complexity | 173.31554 |
Chemical Identifiers
| CAS Number | 92411-99-9 |
|---|---|
| SMILES | CCCCCCCC(C)OC(=S)NCCC |
Product Overview
O-nonan-2-yl Propylaminomethanethioate (CAS 92411-99-9), with molecular formula C13H27NOS and molecular weight 245.18 g/mol. IUPAC: O-nonan-2-yl N-propylcarbamothioate.
Chemical Property Profile of O-nonan-2-yl Propylaminomethanethioate
Property Insights of O-nonan-2-yl Propylaminomethanethioate
The XLogP value of 4.0365 indicates that O-nonan-2-yl Propylaminomethanethioate 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-nonan-2-yl Propylaminomethanethioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-nonan-2-yl Propylaminomethanethioate 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-nonan-2-yl Propylaminomethanethioate?
The CAS number of O-nonan-2-yl Propylaminomethanethioate is 92411-99-9.
What is the molecular formula of O-nonan-2-yl Propylaminomethanethioate?
The molecular formula of O-nonan-2-yl Propylaminomethanethioate is C13H27NOS.
What is the molecular weight of O-nonan-2-yl Propylaminomethanethioate?
The molecular weight of O-nonan-2-yl Propylaminomethanethioate is 245.18 g/mol.
Where can I buy O-nonan-2-yl Propylaminomethanethioate?
You can request a quote for O-nonan-2-yl Propylaminomethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-nonan-2-yl Propylaminomethanethioate?
Yes, KEHONG BIO provides custom synthesis services for O-nonan-2-yl Propylaminomethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.