Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)
TL;DR: Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) (CAS 36783-07-0) is a chemical compound with molecular formula C13H17N2O5PS and molecular weight 344.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(1,3-dioxoisoindol-2-yl)propylamino]ethylsulfanylphosphonic acid
Also Known As: 2-(3-Phthalimidopropylamino)ethanethiol hydrogen phosphate (ester), Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester), N-(3-(2-Mercaptoethylamino)propyl)phthalimide, hydrogen phosphate (ester), Phosphorothioic acid, S-ester with N-(3-((mercaptoethyl)amino)propyl)phthalimide, Phthalimide, N-(3-(2-mercaptoethylamino)propyl)-, hydrogen phosphate (ester)
| Molecular Formula | C13H17N2O5PS |
|---|---|
| Molecular Weight | 344.06 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 344.05957 |
| Heavy Atoms | 22 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 36783-07-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCNCCSP(=O)(O)O |
| InChIKey | WMBSOPACLSAILY-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) (CAS 36783-07-0), with molecular formula C13H17N2O5PS and molecular weight 344.06 g/mol. IUPAC: 2-[3-(1,3-dioxoisoindol-2-yl)propylamino]ethylsulfanylphosphonic acid.
Chemical Property Profile of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)
Property Insights of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)
The XLogP value of -2.3 indicates that Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester). Following Lipinski's Rule of Five, Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) has 3 hydrogen bond donor(s) and 7 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 Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)?
The CAS number of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) is 36783-07-0.
What is the molecular formula of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)?
The molecular formula of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) is C13H17N2O5PS.
What is the molecular weight of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)?
The molecular weight of Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) is 344.06 g/mol.
Where can I buy Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)?
You can request a quote for Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-(3-phthalimidopropylamino)-, hydrogen phosphate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.