N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid
TL;DR: N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid (CAS 582-05-8) is a chemical compound with molecular formula C13H19N3OS and molecular weight 265.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-morpholin-4-ylethyl)-3-phenylthiourea
Also Known As: 1-(2-Morpholinoethyl)-3-phenylthiourea, 1-Trimethylsilyloxynorbornen, NCIOpen2_007232, 1- -3-PHENYLTHIOUREA, 1-(2-morpholin-4-ylethyl)-3-phenylthiourea
| Molecular Formula | C13H19N3OS |
|---|---|
| Molecular Weight | 265.12 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 68.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.12488 |
| Heavy Atoms | 18 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 582-05-8 |
|---|---|
| SMILES | C1COCCN1CCNC(=S)NC2=CC=CC=C2 |
| InChIKey | ULYUELUHTXYHQQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid (CAS 582-05-8), with molecular formula C13H19N3OS and molecular weight 265.12 g/mol. IUPAC: 1-(2-morpholin-4-ylethyl)-3-phenylthiourea.
Chemical Property Profile of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid
Property Insights of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid. The TPSA of 68.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid. Following Lipinski's Rule of Five, N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid has 2 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 N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid?
The CAS number of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid is 582-05-8.
What is the molecular formula of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid?
The molecular formula of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid is C13H19N3OS.
What is the molecular weight of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid?
The molecular weight of N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid is 265.12 g/mol.
Where can I buy N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid?
You can request a quote for N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid?
Yes, KEHONG BIO provides custom synthesis services for N'-(2-(Morpholin-4-yl)ethyl)-N-phenylcarbamimidothioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.