Ro 8-7699
TL;DR: Ro 8-7699 (CAS 50890-42-1) is a chemical compound with molecular formula C20H26O3 and molecular weight 314.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E,6E,8E)-9-(2-acetyl-5,5-dimethylcyclopenten-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid
Also Known As: DACP analog of retinoic acid, Ro 8-7699, (2E,4E,6E,8E)-9-(2-acetyl-5,5-dimethylcyclopenten-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid, (2Z)-2-CYANO-N-(4-HYDROXYPHENYL)-3-PHENYLACRYLAMIDE, 9-(2-Acetyl-5,5-dimethyl-1-cyclopenten-1-yl)-3,7-dimethyl-2,4,6,8-nonatetraenoic acid (all-E)-
| Molecular Formula | C20H26O3 |
|---|---|
| Molecular Weight | 314.19 g/mol |
| LogP | 4.7816 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.1882 |
| Heavy Atoms | 23 |
| Complexity | 637.7979 |
Chemical Identifiers
| CAS Number | 50890-42-1 |
|---|---|
| SMILES | C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C1=C(CCC1(C)C)C(=O)C |
Product Overview
Ro 8-7699 (CAS 50890-42-1), with molecular formula C20H26O3 and molecular weight 314.19 g/mol. IUPAC: (2E,4E,6E,8E)-9-(2-acetyl-5,5-dimethylcyclopenten-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenoic acid.
Chemical Property Profile of Ro 8-7699
Property Insights of Ro 8-7699
The XLogP value of 4.7816 indicates that Ro 8-7699 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, Ro 8-7699 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ro 8-7699 has 1 hydrogen bond donor(s) and 2 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 Ro 8-7699?
The CAS number of Ro 8-7699 is 50890-42-1.
What is the molecular formula of Ro 8-7699?
The molecular formula of Ro 8-7699 is C20H26O3.
What is the molecular weight of Ro 8-7699?
The molecular weight of Ro 8-7699 is 314.19 g/mol.
Where can I buy Ro 8-7699?
You can request a quote for Ro 8-7699 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 8-7699?
Yes, KEHONG BIO provides custom synthesis services for Ro 8-7699 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.