RefChem:1075737
TL;DR: RefChem:1075737 (CAS 74789-22-3) is a chemical compound with molecular formula C6H13O4PS2 and molecular weight 244.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[methoxy(methyl)phosphoryl]sulfanylmethylsulfanyl]acetate
Also Known As: methyl 2-[[methoxy(methyl)phosphoryl]sulfanylmethylsulfanyl]acetate, Acetic acid, 2-(mercaptomethylthio)-, methyl ester, S-ester with O-methyl methylphosphonothioate, Methyl 3-methyl-3-oxo-2-oxa-4,6-dithia-3lambda~5~-phosphaoctan-8-oate, ACETIC ACID, 2-(MERCAPTOMETHYLTHIO)-, METHYL ESTER, S-ESTER with O-METHYL METHYL, RefChem:1075737
| Molecular Formula | C6H13O4PS2 |
|---|---|
| Molecular Weight | 244.00 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 243.99928 |
| Heavy Atoms | 13 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 74789-22-3 |
|---|---|
| SMILES | COC(=O)CSCSP(=O)(C)OC |
| InChIKey | SKDFMOMSRVTQEW-UHFFFAOYSA-N |
Product Overview
RefChem:1075737 (CAS 74789-22-3), with molecular formula C6H13O4PS2 and molecular weight 244.00 g/mol. IUPAC: methyl 2-[[methoxy(methyl)phosphoryl]sulfanylmethylsulfanyl]acetate.
Chemical Property Profile of RefChem:1075737
Property Insights of RefChem:1075737
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1075737. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1075737. Following Lipinski's Rule of Five, RefChem:1075737 has 0 hydrogen bond donor(s) and 6 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:1075737?
The CAS number of RefChem:1075737 is 74789-22-3.
What is the molecular formula of RefChem:1075737?
The molecular formula of RefChem:1075737 is C6H13O4PS2.
What is the molecular weight of RefChem:1075737?
The molecular weight of RefChem:1075737 is 244.00 g/mol.
Where can I buy RefChem:1075737?
You can request a quote for RefChem:1075737 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075737?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075737 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.