Ro 03-9454
TL;DR: Ro 03-9454 (CAS 7251-72-1) is a chemical compound with molecular formula C15H26N5O4 and molecular weight 340.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: Ro 03-9454, KST-1A7862, (4-{[2-hydroxy-3-(2-nitro-1h-imidazol-1-yl)propyl]amino}-2,2,6,6-tetramethylpiperidin-1-yl)oxidanyl, 1-Piperidinyloxy, 4-((2-hydroxy-3-(2-nitro-1H-imidazol-1-yl)propyl)amino)-2,2,6,6-tetramethyl-, 4-[[2-Hydroxy-3-(2-nitro-1H-imidazol-1-yl)propyl]amino]-2,2,6,6-tetramethyl-1-piperidinyloxy
| Molecular Formula | C15H26N5O4 |
|---|---|
| Molecular Weight | 340.20 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.1985 |
| Heavy Atoms | 24 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 7251-72-1 |
|---|---|
| SMILES | CC1(CC(CC(N1[O])(C)C)NCC(CN2C=CN=C2[N+](=O)[O-])O)C |
| InChIKey | IKSXGGNRWXPODG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ro 03-9454 (CAS 7251-72-1), with molecular formula C15H26N5O4 and molecular weight 340.20 g/mol.
Chemical Property Profile of Ro 03-9454
Property Insights of Ro 03-9454
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ro 03-9454. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ro 03-9454. Following Lipinski's Rule of Five, Ro 03-9454 has 2 hydrogen bond donor(s) and 6 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 03-9454?
The CAS number of Ro 03-9454 is 7251-72-1.
What is the molecular formula of Ro 03-9454?
The molecular formula of Ro 03-9454 is C15H26N5O4.
What is the molecular weight of Ro 03-9454?
The molecular weight of Ro 03-9454 is 340.20 g/mol.
Where can I buy Ro 03-9454?
You can request a quote for Ro 03-9454 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 03-9454?
Yes, KEHONG BIO provides custom synthesis services for Ro 03-9454 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.