Ro 8-2580
TL;DR: Ro 8-2580 (CAS 38915-09-2) is a chemical compound with molecular formula C25H36N4O3 and molecular weight 440.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol
Also Known As: Ro 8-2580, 1,3-Bis(4-(p-methoxyphenyl)piperazinyl)-2-propanol, Ro-8-2580, 1,3-bis[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol, 1,3-Bis[4-(p-methoxyphenyl)-1-piperazinyl]-2-propanol
| Molecular Formula | C25H36N4O3 |
|---|---|
| Molecular Weight | 440.28 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 51.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 440.27875 |
| Heavy Atoms | 32 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 38915-09-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CC(CN3CCN(CC3)C4=CC=C(C=C4)OC)O |
| InChIKey | VHPOJFNPMOMKPV-UHFFFAOYSA-N |
Product Overview
Ro 8-2580 (CAS 38915-09-2), with molecular formula C25H36N4O3 and molecular weight 440.28 g/mol. IUPAC: 1,3-bis[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol.
Chemical Property Profile of Ro 8-2580
Property Insights of Ro 8-2580
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ro 8-2580. With a topological polar surface area (TPSA) of 51.7 Ų, Ro 8-2580 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ro 8-2580 has 1 hydrogen bond donor(s) and 7 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 8-2580?
The CAS number of Ro 8-2580 is 38915-09-2.
What is the molecular formula of Ro 8-2580?
The molecular formula of Ro 8-2580 is C25H36N4O3.
What is the molecular weight of Ro 8-2580?
The molecular weight of Ro 8-2580 is 440.28 g/mol.
Where can I buy Ro 8-2580?
You can request a quote for Ro 8-2580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 8-2580?
Yes, KEHONG BIO provides custom synthesis services for Ro 8-2580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.