N4-Phenethylmorpholine-4-carbothioamide
TL;DR: N4-Phenethylmorpholine-4-carbothioamide (CAS 284488-77-3) is a chemical compound with molecular formula C13H18N2OS and molecular weight 250.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenylethyl)morpholine-4-carbothioamide
Also Known As: N-phenethylmorpholine-4-carbothioamide, N4-Phenethylmorpholine-4-carbothioamide, N-Phenethyl-4-morpholinecarbothioamide, N-(2-phenylethyl)morpholine-4-carbothioamide, J3.678.596I
| Molecular Formula | C13H18N2OS |
|---|---|
| Molecular Weight | 250.11 g/mol |
| LogP | 1.4358 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.11398 |
| Heavy Atoms | 17 |
| Complexity | 349.6969 |
Chemical Identifiers
| CAS Number | 284488-77-3 |
|---|---|
| SMILES | C1COCCN1C(=S)NCCC2=CC=CC=C2 |
Product Overview
N4-Phenethylmorpholine-4-carbothioamide (CAS 284488-77-3), with molecular formula C13H18N2OS and molecular weight 250.11 g/mol. IUPAC: N-(2-phenylethyl)morpholine-4-carbothioamide.
Chemical Property Profile of N4-Phenethylmorpholine-4-carbothioamide
Property Insights of N4-Phenethylmorpholine-4-carbothioamide
The XLogP value of 1.4358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N4-Phenethylmorpholine-4-carbothioamide. With a topological polar surface area (TPSA) of 24.5 Ų, N4-Phenethylmorpholine-4-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N4-Phenethylmorpholine-4-carbothioamide 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 N4-Phenethylmorpholine-4-carbothioamide?
The CAS number of N4-Phenethylmorpholine-4-carbothioamide is 284488-77-3.
What is the molecular formula of N4-Phenethylmorpholine-4-carbothioamide?
The molecular formula of N4-Phenethylmorpholine-4-carbothioamide is C13H18N2OS.
What is the molecular weight of N4-Phenethylmorpholine-4-carbothioamide?
The molecular weight of N4-Phenethylmorpholine-4-carbothioamide is 250.11 g/mol.
Where can I buy N4-Phenethylmorpholine-4-carbothioamide?
You can request a quote for N4-Phenethylmorpholine-4-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N4-Phenethylmorpholine-4-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N4-Phenethylmorpholine-4-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.