愈创甘油醚氨基甲酸酯
TL;DR: 愈创甘油醚氨基甲酸酯 (CAS 24017-24-1) is a chemical compound with molecular formula C13H16NO3PS2 and molecular weight 329.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
愈创甘油醚氨基甲酸酯
2-[[ethoxy(ethyl)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione
Also Known As: Guaiphensin carbamate, O-Ethyl-S-(phthalimidomethyl)-ethylphosphonodithioate, N-(Mercaptomethyl)phthalimide-S-(O-ethyl)-ethylphosphonodithioate, 2-[[ethoxy(ethyl)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione, Phosphonodithioic acid, ethyl-, O-ethyl ester, S-ester with N-(mercaptomethyl)phthalimide
| Molecular Formula | C13H16NO3PS2 |
|---|---|
| Molecular Weight | 329.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.0309 |
| Heavy Atoms | 20 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 24017-24-1 |
|---|---|
| SMILES | CCOP(=S)(CC)SCN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | MRNTWTRUPWODMD-UHFFFAOYSA-N |
Product Overview
愈创甘油醚氨基甲酸酯 (CAS 24017-24-1), with molecular formula C13H16NO3PS2 and molecular weight 329.03 g/mol. IUPAC: 2-[[ethoxy(ethyl)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione.
Chemical Property Profile of 愈创甘油醚氨基甲酸酯
Property Insights of 愈创甘油醚氨基甲酸酯
The XLogP value of 3.5 indicates that 愈创甘油醚氨基甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 愈创甘油醚氨基甲酸酯. Following Lipinski's Rule of Five, 愈创甘油醚氨基甲酸酯 has 0 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 愈创甘油醚氨基甲酸酯?
The CAS number of 愈创甘油醚氨基甲酸酯 is 24017-24-1.
What is the molecular formula of 愈创甘油醚氨基甲酸酯?
The molecular formula of 愈创甘油醚氨基甲酸酯 is C13H16NO3PS2.
What is the molecular weight of 愈创甘油醚氨基甲酸酯?
The molecular weight of 愈创甘油醚氨基甲酸酯 is 329.03 g/mol.
Where can I buy 愈创甘油醚氨基甲酸酯?
You can request a quote for 愈创甘油醚氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 愈创甘油醚氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 愈创甘油醚氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.