Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester
TL;DR: Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester (CAS 62052-68-0) is a chemical compound with molecular formula C18H27NO7S2 and molecular weight 433.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 2-[4-(2-morpholin-4-ylacetyl)oxy-1,3-dithiolan-2-ylidene]propanedioate
Also Known As: Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester, Dipropan-2-yl 2-[4-(2-morpholin-4-ylacetyl)oxy-1,3-dithiolan-2-ylidene]propanedioate, Di(propan-2-yl) (4-{[(morpholin-4-yl)acetyl]oxy}-1,3-dithiolan-2-ylidene)propanedioate, Dipropan-2-yl (4-{[(morpholin-4-yl)acetyl]oxy}-1,3-dithiolan-2-ylidene)propanedioate, RefChem:373643
| Molecular Formula | C18H27NO7S2 |
|---|---|
| Molecular Weight | 433.12 g/mol |
| LogP | 1.7827 |
| Topological Polar Surface Area | 91.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.1229 |
| Heavy Atoms | 28 |
| Complexity | 591.05536 |
Chemical Identifiers
| CAS Number | 62052-68-0 |
|---|---|
| SMILES | CC(C)OC(=O)C(=C1SCC(S1)OC(=O)CN2CCOCC2)C(=O)OC(C)C |
Product Overview
Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester (CAS 62052-68-0), with molecular formula C18H27NO7S2 and molecular weight 433.12 g/mol. IUPAC: dipropan-2-yl 2-[4-(2-morpholin-4-ylacetyl)oxy-1,3-dithiolan-2-ylidene]propanedioate.
Chemical Property Profile of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester
Property Insights of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester
The XLogP value of 1.7827 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester. The TPSA of 91.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester. Following Lipinski's Rule of Five, Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester has 0 hydrogen bond donor(s) and 10 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 Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester?
The CAS number of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester is 62052-68-0.
What is the molecular formula of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester?
The molecular formula of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester is C18H27NO7S2.
What is the molecular weight of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester?
The molecular weight of Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester is 433.12 g/mol.
Where can I buy Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester?
You can request a quote for Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Popanedioic acid, (4-((4-morpholinylacetyl)oxy)-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.