Demethyl medicarpin
TL;DR: Demethyl medicarpin (CAS 105815-70-1) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol
Also Known As: demethylmedicarpin, Medicarpin, Demethyl medicarpin, 3,9-Dihydroxypterocarpan, J1.904.414I
Technical Specifications
| Molecular Formula | C15H12O4 |
| Molecular Weight | 256.07355 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 256.07355 Da |
| Heavy Atoms | 19 |
| Complexity | 347.0 |
| SMILES | C1C2C(C3=C(O1)C=C(C=C3)O)OC4=C2C=CC(=C4)O |
| InChIKey | ODMIEGVTNZNSLD-UHFFFAOYSA-N |
Chemical Property Profile of Demethyl medicarpin
Property Insights of Demethyl medicarpin
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Demethyl medicarpin. With a topological polar surface area (TPSA) of 58.9 Ų, Demethyl medicarpin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Demethyl medicarpin has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Demethyl medicarpin?
The CAS number of Demethyl medicarpin is 105815-70-1.
What is the molecular formula of Demethyl medicarpin?
The molecular formula of Demethyl medicarpin is C15H12O4.
What is the molecular weight of Demethyl medicarpin?
The molecular weight of Demethyl medicarpin is 256.07355 g/mol.
Where can I buy Demethyl medicarpin?
You can request a quote for Demethyl medicarpin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Demethyl medicarpin?
Yes, CoreyChem provides custom synthesis services for Demethyl medicarpin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.