Ro 31-3294
TL;DR: Ro 31-3294 (CAS 132098-65-8) is a chemical compound with molecular formula C30H35NO9 and molecular weight 553.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-ethyl-6,9,11-trihydroxy-7-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: Ro 31-3294, Ro 313294, 9-ethyl-6,9,11-trihydroxy-7-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-8,10-dihydro-7H-tetracene-5,12-dione, 3-ethyl-3,5,12-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 2,3,6-trideoxy-3-morpholin-4-ylhexopyranoside, (7S-cis)-9-Ethyl-7,8,9,10-tetrahydro-6,9,11-trihydroxy-7-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione
| Molecular Formula | C30H35NO9 |
|---|---|
| Molecular Weight | 553.23 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 553.2312 |
| Heavy Atoms | 40 |
| Complexity | 957.0 |
Chemical Identifiers
| CAS Number | 132098-65-8 |
|---|---|
| SMILES | CCC1(CC(C2=C(C1)C(=C3C(=C2O)C(=O)C4=CC=CC=C4C3=O)O)OC5CC(C(C(O5)C)O)N6CCOCC6)O |
| InChIKey | ZCKWTLZBQRUDED-UHFFFAOYSA-N |
Product Overview
Ro 31-3294 (CAS 132098-65-8), with molecular formula C30H35NO9 and molecular weight 553.23 g/mol. IUPAC: 9-ethyl-6,9,11-trihydroxy-7-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of Ro 31-3294
Property Insights of Ro 31-3294
The XLogP value of 3.6 indicates that Ro 31-3294 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting Ro 31-3294 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ro 31-3294 has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ro 31-3294?
The CAS number of Ro 31-3294 is 132098-65-8.
What is the molecular formula of Ro 31-3294?
The molecular formula of Ro 31-3294 is C30H35NO9.
What is the molecular weight of Ro 31-3294?
The molecular weight of Ro 31-3294 is 553.23 g/mol.
Where can I buy Ro 31-3294?
You can request a quote for Ro 31-3294 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 31-3294?
Yes, KEHONG BIO provides custom synthesis services for Ro 31-3294 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.