N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid
TL;DR: N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid (CAS 68061-01-8) is a chemical compound with molecular formula C14H20N2O4S and molecular weight 312.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4,5-trimethoxyphenyl)thiomorpholine-4-carboxamide
Also Known As: N-(3,4,5-Trimethoxyphenyl)-4-thiomorpholinecarboxamide, 4-Thiomorpholinecarboxamide, N-(3,4,5-trimethoxyphenyl)-, N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid, N-(3,4,5-trimethoxyphenyl)thiomorpholine-4-carboxamide, RefChem:1091103
| Molecular Formula | C14H20N2O4S |
|---|---|
| Molecular Weight | 312.11 g/mol |
| LogP | 2.2931 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.11438 |
| Heavy Atoms | 21 |
| Complexity | 478.74252 |
Chemical Identifiers
| CAS Number | 68061-01-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)NC(=O)N2CCSCC2 |
Product Overview
N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid (CAS 68061-01-8), with molecular formula C14H20N2O4S and molecular weight 312.11 g/mol. IUPAC: N-(3,4,5-trimethoxyphenyl)thiomorpholine-4-carboxamide.
Chemical Property Profile of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid
Property Insights of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid
The XLogP value of 2.2931 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid. The TPSA of 60.03 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid. Following Lipinski's Rule of Five, N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid has 1 hydrogen bond donor(s) and 5 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 N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid?
The CAS number of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid is 68061-01-8.
What is the molecular formula of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid?
The molecular formula of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid is C14H20N2O4S.
What is the molecular weight of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid?
The molecular weight of N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid is 312.11 g/mol.
Where can I buy N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid?
You can request a quote for N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4,5-Trimethoxyphenyl)thiomorpholine-4-carboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.