3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose
TL;DR: 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose (CAS 14164-31-9) is a chemical compound with molecular formula C16H17NO6 and molecular weight 319.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(hydroxymethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]isoindole-1,3-dione
Also Known As: 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose, 2-[5-(hydroxymethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]isoindole-1,3-dione, 2-[5-(hydroxymethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]isoindoline-1,3-dione
| Molecular Formula | C16H17NO6 |
|---|---|
| Molecular Weight | 319.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.1056 |
| Heavy Atoms | 23 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 14164-31-9 |
|---|---|
| SMILES | CC1(OC2C(C(OC2O1)CO)N3C(=O)C4=CC=CC=C4C3=O)C |
| InChIKey | JGBVCIZIHVLUHU-UHFFFAOYSA-N |
Product Overview
3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose (CAS 14164-31-9), with molecular formula C16H17NO6 and molecular weight 319.11 g/mol. IUPAC: 2-[5-(hydroxymethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]isoindole-1,3-dione.
Chemical Property Profile of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose
Property Insights of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose. Following Lipinski's Rule of Five, 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose has 1 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 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose?
The CAS number of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose is 14164-31-9.
What is the molecular formula of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose?
The molecular formula of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose is C16H17NO6.
What is the molecular weight of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose?
The molecular weight of 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose is 319.11 g/mol.
Where can I buy 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose?
You can request a quote for 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose?
Yes, KEHONG BIO provides custom synthesis services for 3-deoxy-3-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-1,2-o-(1-methylethylidene)pentofuranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.