Hypoestestatin 2
TL;DR: Hypoestestatin 2 (CAS 5395-11-9) is a chemical compound with molecular formula C23H25NO4 and molecular weight 379.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13aS,14R)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizin-14-ol
Also Known As: Hypoestestatin 2, (13aS,14R)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizin-14-ol, dibenzo(f,h)pyrrolo(1,2-b)isoquinolin-14-ol, 9,11,12,13,13a,14-hexahydro-2,3,6-trimethoxy-,(13as-cis)-, 2,3,6-Trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinolin-14-ol, (13aS,14R)-2,3,6-Trimethoxy-9,11,12,13,13a,14-hexahydrodibenzo[f,h]pyrrolo[1,2-b]isoquinolin-14-ol
| Molecular Formula | C23H25NO4 |
|---|---|
| Molecular Weight | 379.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.17834 |
| Heavy Atoms | 28 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 5395-11-9 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C([C@H]([C@@H]4CCCN4C3)O)C5=CC(=C(C=C52)OC)OC |
| InChIKey | VEPWWLXWVFFRLY-CVDCTZTESA-N |
Product Overview
Hypoestestatin 2 (CAS 5395-11-9), with molecular formula C23H25NO4 and molecular weight 379.18 g/mol. IUPAC: (13aS,14R)-2,3,6-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizin-14-ol.
Chemical Property Profile of Hypoestestatin 2
Property Insights of Hypoestestatin 2
The XLogP value of 3.6 indicates that Hypoestestatin 2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Hypoestestatin 2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hypoestestatin 2 has 1 hydrogen bond donor(s) and 5 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 Hypoestestatin 2?
The CAS number of Hypoestestatin 2 is 5395-11-9.
What is the molecular formula of Hypoestestatin 2?
The molecular formula of Hypoestestatin 2 is C23H25NO4.
What is the molecular weight of Hypoestestatin 2?
The molecular weight of Hypoestestatin 2 is 379.18 g/mol.
Where can I buy Hypoestestatin 2?
You can request a quote for Hypoestestatin 2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hypoestestatin 2?
Yes, KEHONG BIO provides custom synthesis services for Hypoestestatin 2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.