syn HH coumarin dimer
TL;DR: syn HH coumarin dimer (CAS 5248-11-3) is a chemical compound with molecular formula C18H12O4 and molecular weight 292.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,11R,12S)-9,14-dioxapentacyclo[10.8.0.02,11.03,8.015,20]icosa-3,5,7,15,17,19-hexaene-10,13-dione
Also Known As: syn HH coumarin dimer, (3S)-3alpha,3 beta-Cyclo-4alpha,4 beta-bi[3,4-dihydro-2H-1-benzopyran-2-one], (3S,4S,3 R,4 R)-4,4 -Cyclo-3,3 -bi(3,4-dihydro-2H-1-benzopyran-2-one), (1R,2S,11S,12R)-9,14-dioxapentacyclo[10.8.0.02,11.03,8.015,20]icosa-3,5,7,15,17,19-hexaene-10,13-dione, (4S,4 R)-4,4 -Cyclo[(3S,3 R)-3,3 -bi(3,4-dihydro-2H-1-benzopyran)]-2,2 -dione
| Molecular Formula | C18H12O4 |
|---|---|
| Molecular Weight | 292.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 292.07355 |
| Heavy Atoms | 22 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 5248-11-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)[C@@H]3[C@H]4[C@@H]([C@@H]3C(=O)O2)C(=O)OC5=CC=CC=C45 |
| InChIKey | LLDOJHIQWQQUIQ-GEEKYZPCSA-N |
Product Overview
syn HH coumarin dimer (CAS 5248-11-3), with molecular formula C18H12O4 and molecular weight 292.07 g/mol. IUPAC: (1S,2R,11R,12S)-9,14-dioxapentacyclo[10.8.0.02,11.03,8.015,20]icosa-3,5,7,15,17,19-hexaene-10,13-dione.
Chemical Property Profile of syn HH coumarin dimer
Property Insights of syn HH coumarin dimer
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for syn HH coumarin dimer. With a topological polar surface area (TPSA) of 52.6 Ų, syn HH coumarin dimer exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, syn HH coumarin dimer has 0 hydrogen bond donor(s) and 4 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 syn HH coumarin dimer?
The CAS number of syn HH coumarin dimer is 5248-11-3.
What is the molecular formula of syn HH coumarin dimer?
The molecular formula of syn HH coumarin dimer is C18H12O4.
What is the molecular weight of syn HH coumarin dimer?
The molecular weight of syn HH coumarin dimer is 292.07 g/mol.
Where can I buy syn HH coumarin dimer?
You can request a quote for syn HH coumarin dimer directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for syn HH coumarin dimer?
Yes, KEHONG BIO provides custom synthesis services for syn HH coumarin dimer and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.