(4-Ethoxyphenyl)(morpholin-4-yl)methanethione
TL;DR: (4-Ethoxyphenyl)(morpholin-4-yl)methanethione (CAS 339306-06-8) is a chemical compound with molecular formula C13H17NO2S and molecular weight 251.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethoxyphenyl)-morpholin-4-ylmethanethione
Also Known As: 4-(4-Ethoxythiobenzoyl)morpholine, (4-Ethoxyphenyl)-4-morpholinylmethanethione, 4-(4-ethoxybenzenecarbothioyl)morpholine, (4-ethoxyphenyl)(morpholin-4-yl)methanethione, BIM-0036025.P001
| Molecular Formula | C13H17NO2S |
|---|---|
| Molecular Weight | 251.10 g/mol |
| LogP | 2.093 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.098 |
| Heavy Atoms | 17 |
| Complexity | 371.51077 |
Chemical Identifiers
| CAS Number | 339306-06-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=S)N2CCOCC2 |
Product Overview
(4-Ethoxyphenyl)(morpholin-4-yl)methanethione (CAS 339306-06-8), with molecular formula C13H17NO2S and molecular weight 251.10 g/mol. IUPAC: (4-ethoxyphenyl)-morpholin-4-ylmethanethione.
Chemical Property Profile of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione
Property Insights of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione
The XLogP value of 2.093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Ethoxyphenyl)(morpholin-4-yl)methanethione. With a topological polar surface area (TPSA) of 21.7 Ų, (4-Ethoxyphenyl)(morpholin-4-yl)methanethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Ethoxyphenyl)(morpholin-4-yl)methanethione has 0 hydrogen bond donor(s) and 3 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 (4-Ethoxyphenyl)(morpholin-4-yl)methanethione?
The CAS number of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione is 339306-06-8.
What is the molecular formula of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione?
The molecular formula of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione is C13H17NO2S.
What is the molecular weight of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione?
The molecular weight of (4-Ethoxyphenyl)(morpholin-4-yl)methanethione is 251.10 g/mol.
Where can I buy (4-Ethoxyphenyl)(morpholin-4-yl)methanethione?
You can request a quote for (4-Ethoxyphenyl)(morpholin-4-yl)methanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Ethoxyphenyl)(morpholin-4-yl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (4-Ethoxyphenyl)(morpholin-4-yl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.