1-(Phenylthio)-2-aminopropane
TL;DR: 1-(Phenylthio)-2-aminopropane (CAS 2014-77-9) is a chemical compound with molecular formula C9H13NS and molecular weight 167.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylsulfanylpropan-2-amine
Also Known As: Mepaes, 1-(Phenylthio)-2-aminopropane, 1-phenylsulfanylpropan-2-amine, 1- -2-aminopropane, 1-(phenylsulfanyl)propan-2-amine
| Molecular Formula | C9H13NS |
|---|---|
| Molecular Weight | 167.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.07687 |
| Heavy Atoms | 11 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 2014-77-9 |
|---|---|
| SMILES | CC(CSC1=CC=CC=C1)N |
| InChIKey | YAUHFKDKQAMMJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Phenylthio)-2-aminopropane (CAS 2014-77-9), with molecular formula C9H13NS and molecular weight 167.08 g/mol. IUPAC: 1-phenylsulfanylpropan-2-amine.
Chemical Property Profile of 1-(Phenylthio)-2-aminopropane
Property Insights of 1-(Phenylthio)-2-aminopropane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Phenylthio)-2-aminopropane. With a topological polar surface area (TPSA) of 51.3 Ų, 1-(Phenylthio)-2-aminopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Phenylthio)-2-aminopropane 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 1-(Phenylthio)-2-aminopropane?
The CAS number of 1-(Phenylthio)-2-aminopropane is 2014-77-9.
What is the molecular formula of 1-(Phenylthio)-2-aminopropane?
The molecular formula of 1-(Phenylthio)-2-aminopropane is C9H13NS.
What is the molecular weight of 1-(Phenylthio)-2-aminopropane?
The molecular weight of 1-(Phenylthio)-2-aminopropane is 167.08 g/mol.
Where can I buy 1-(Phenylthio)-2-aminopropane?
You can request a quote for 1-(Phenylthio)-2-aminopropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Phenylthio)-2-aminopropane?
Yes, KEHONG BIO provides custom synthesis services for 1-(Phenylthio)-2-aminopropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.