1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine
TL;DR: 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine (CAS 76254-71-2) is a chemical compound with molecular formula C8H9NOS and molecular weight 167.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-1-sulfinylethanamine
Also Known As: 2-phenyl-1-sulfinylethanamine, 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine
| Molecular Formula | C8H9NOS |
|---|---|
| Molecular Weight | 167.04 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.04048 |
| Heavy Atoms | 11 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 76254-71-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=S=O)N |
| InChIKey | NJNOXTXDTVRDIL-UHFFFAOYSA-N |
Product Overview
1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine (CAS 76254-71-2), with molecular formula C8H9NOS and molecular weight 167.04 g/mol. IUPAC: 2-phenyl-1-sulfinylethanamine.
Chemical Property Profile of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine
Property Insights of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine. With a topological polar surface area (TPSA) of 44.1 Ų, 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine 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-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine?
The CAS number of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine is 76254-71-2.
What is the molecular formula of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine?
The molecular formula of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine is C8H9NOS.
What is the molecular weight of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine?
The molecular weight of 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine is 167.04 g/mol.
Where can I buy 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine?
You can request a quote for 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Oxo-lambda~4~-sulfanylidene)-2-phenylethan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.