2-Phthalimidoethanethiol
TL;DR: 2-Phthalimidoethanethiol (CAS 4490-75-9) is a chemical compound with molecular formula C10H9NO2S and molecular weight 207.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-sulfanylethyl)isoindole-1,3-dione
Also Known As: Ethanethiol, 2-phthalimido-, 2-(2-Mercaptoethyl)isoindoline-1,3-dione, Phthalimidoethanethiol, 2-Phthalimidoethanethiol, propylpropionate
| Molecular Formula | C10H9NO2S |
|---|---|
| Molecular Weight | 207.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.0354 |
| Heavy Atoms | 14 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 4490-75-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCS |
| InChIKey | UHOPWFKONJYLCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phthalimidoethanethiol (CAS 4490-75-9), with molecular formula C10H9NO2S and molecular weight 207.04 g/mol. IUPAC: 2-(2-sulfanylethyl)isoindole-1,3-dione.
Chemical Property Profile of 2-Phthalimidoethanethiol
Property Insights of 2-Phthalimidoethanethiol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phthalimidoethanethiol. With a topological polar surface area (TPSA) of 38.4 Ų, 2-Phthalimidoethanethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phthalimidoethanethiol has 1 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 2-Phthalimidoethanethiol?
The CAS number of 2-Phthalimidoethanethiol is 4490-75-9.
What is the molecular formula of 2-Phthalimidoethanethiol?
The molecular formula of 2-Phthalimidoethanethiol is C10H9NO2S.
What is the molecular weight of 2-Phthalimidoethanethiol?
The molecular weight of 2-Phthalimidoethanethiol is 207.04 g/mol.
Where can I buy 2-Phthalimidoethanethiol?
You can request a quote for 2-Phthalimidoethanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phthalimidoethanethiol?
Yes, KEHONG BIO provides custom synthesis services for 2-Phthalimidoethanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.