N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate
TL;DR: N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate (CAS 23694-15-7) is a chemical compound with molecular formula C17H29N2O6PS and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-ethylpyrrolidin-2-yl)methyl]-5-ethylsulfanyl-2-methoxybenzamide;phosphoric acid
Also Known As: EINECS 245-828-5, N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate, N-[(1-ethylpyrrolidin-2-yl)methyl]-5-(ethylthio)-2-methoxybenzamide phosphate, N-[(1-ethylpyrrolidin-2-yl)methyl]-5-ethylsulfanyl-2-methoxy-benzamide phosphate, N-[(1-ethylpyrrolidin-2-yl)methyl]-5-ethylsulfanyl-2-methoxybenzamide,phosphoric acid
| Molecular Formula | C17H29N2O6PS |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 2.0927 |
| Topological Polar Surface Area | 119.33 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.1484 |
| Heavy Atoms | 27 |
| Complexity | 646.0462 |
Chemical Identifiers
| CAS Number | 23694-15-7 |
|---|---|
| SMILES | CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)SCC)OC.OP(=O)(O)O |
Product Overview
N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate (CAS 23694-15-7), with molecular formula C17H29N2O6PS and molecular weight 420.15 g/mol. IUPAC: N-[(1-ethylpyrrolidin-2-yl)methyl]-5-ethylsulfanyl-2-methoxybenzamide;phosphoric acid.
Chemical Property Profile of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate
Property Insights of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate
The XLogP value of 2.0927 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate. The TPSA of 119.33 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate. Following Lipinski's Rule of Five, N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate has 4 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-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate?
The CAS number of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate is 23694-15-7.
What is the molecular formula of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate?
The molecular formula of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate is C17H29N2O6PS.
What is the molecular weight of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate?
The molecular weight of N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate is 420.15 g/mol.
Where can I buy N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate?
You can request a quote for N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate?
Yes, KEHONG BIO provides custom synthesis services for N-((1-Ethylpyrrolidin-2-yl)methyl)-5-(ethylthio)-2-methoxybenzamide phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.