RefChem:370694
TL;DR: RefChem:370694 (CAS 22243-91-0) is a chemical compound with molecular formula C11H12NO3PS2 and molecular weight 301.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[methoxy(methyl)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione
Also Known As: O-Methyl-S-(phthalimidomethyl)-methylphosphonodithioate, N-(Mercaptomethyl)phthalimide-S-(O-methyl)-methylphosphonodithioate, Phosphonodithioic acid, methyl-, O-methyl ester, S-ester with N-(mercaptomethyl)phthalimide, s-[(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)methyl] o-methylmethylphosphonodithioate, 2-[[methoxy(methyl)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione
| Molecular Formula | C11H12NO3PS2 |
|---|---|
| Molecular Weight | 301.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.99963 |
| Heavy Atoms | 18 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 22243-91-0 |
|---|---|
| SMILES | COP(=S)(C)SCN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | PDPLQAYBEGIJJF-UHFFFAOYSA-N |
Product Overview
RefChem:370694 (CAS 22243-91-0), with molecular formula C11H12NO3PS2 and molecular weight 301.00 g/mol. IUPAC: 2-[[methoxy(methyl)phosphinothioyl]sulfanylmethyl]isoindole-1,3-dione.
Chemical Property Profile of RefChem:370694
Property Insights of RefChem:370694
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:370694. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:370694. Following Lipinski's Rule of Five, RefChem:370694 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 RefChem:370694?
The CAS number of RefChem:370694 is 22243-91-0.
What is the molecular formula of RefChem:370694?
The molecular formula of RefChem:370694 is C11H12NO3PS2.
What is the molecular weight of RefChem:370694?
The molecular weight of RefChem:370694 is 301.00 g/mol.
Where can I buy RefChem:370694?
You can request a quote for RefChem:370694 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:370694?
Yes, KEHONG BIO provides custom synthesis services for RefChem:370694 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.