DDS2_005596
TL;DR: DDS2_005596 (CAS 6083-04-1) is a chemical compound with molecular formula C28H39NO10 and molecular weight 549.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1-benzofuran-3-yl)-2-[2-(2-hydroxyethoxy)ethoxy]-3,4-dihydro-2H-pyran-6-yl]-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
Also Known As: DDS2_005596, [4-(1-benzofuran-3-yl)-2-[2-(2-hydroxyethoxy)ethoxy]-3,4-dihydro-2H-pyran-6-yl]-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone, {4-(1-Benzofuran-3-yl)-2-[2-(2-hydroxyethoxy)ethoxy]-3,4-dihydro-2H-pyran-6-yl}(1,4,7,10-tetraoxa-13-azacyclopentadecan-13-yl)methanone
| Molecular Formula | C28H39NO10 |
|---|---|
| Molecular Weight | 549.26 g/mol |
| LogP | 2.0808 |
| Topological Polar Surface Area | 118.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 549.2574 |
| Heavy Atoms | 39 |
| Complexity | 1008.6924 |
Chemical Identifiers
| CAS Number | 6083-04-1 |
|---|---|
| SMILES | C1COCCOCCOCCOCCN1C(=O)C2=CC(CC(O2)OCCOCCO)C3=COC4=CC=CC=C43 |
Product Overview
DDS2_005596 (CAS 6083-04-1), with molecular formula C28H39NO10 and molecular weight 549.26 g/mol. IUPAC: [4-(1-benzofuran-3-yl)-2-[2-(2-hydroxyethoxy)ethoxy]-3,4-dihydro-2H-pyran-6-yl]-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone.
Chemical Property Profile of DDS2_005596
Property Insights of DDS2_005596
The XLogP value of 2.0808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DDS2_005596. The TPSA of 118.29 Ų falls within the moderate polarity range, balancing permeability and solubility for DDS2_005596. Following Lipinski's Rule of Five, DDS2_005596 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DDS2_005596?
The CAS number of DDS2_005596 is 6083-04-1.
What is the molecular formula of DDS2_005596?
The molecular formula of DDS2_005596 is C28H39NO10.
What is the molecular weight of DDS2_005596?
The molecular weight of DDS2_005596 is 549.26 g/mol.
Where can I buy DDS2_005596?
You can request a quote for DDS2_005596 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DDS2_005596?
Yes, KEHONG BIO provides custom synthesis services for DDS2_005596 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.