Ro-23-9424
TL;DR: Ro-23-9424 (CAS 115622-58-7) is a chemical compound with molecular formula C31H31F3N8O8S2 and molecular weight 764.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyl]oxymethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Ro-23-9424, Ro 23-9424, ro23-9424, (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyl]oxymethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, Ro-23-9424Ro 239424,Ro23-9424
| Molecular Formula | C31H31F3N8O8S2 |
|---|---|
| Molecular Weight | 764.17 g/mol |
| LogP | 0.9858 |
| Topological Polar Surface Area | 201.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 11 |
| Exact Mass | 764.16583 |
| Heavy Atoms | 52 |
| Complexity | 2099.1528 |
Chemical Identifiers
| CAS Number | 115622-58-7 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)OCC4=C(N5[C@@H]([C@@H](C5=O)NC(=O)/C(=N\OC)/C6=CSC(=N6)N)SC4)C(=O)O)CCF)F |
Product Overview
Ro-23-9424 (CAS 115622-58-7), with molecular formula C31H31F3N8O8S2 and molecular weight 764.17 g/mol. IUPAC: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyl]oxymethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Ro-23-9424
Property Insights of Ro-23-9424
The XLogP value of 0.9858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ro-23-9424. The TPSA of 201.99 Ų indicates high polarity, suggesting Ro-23-9424 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ro-23-9424 has 3 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ro-23-9424?
The CAS number of Ro-23-9424 is 115622-58-7.
What is the molecular formula of Ro-23-9424?
The molecular formula of Ro-23-9424 is C31H31F3N8O8S2.
What is the molecular weight of Ro-23-9424?
The molecular weight of Ro-23-9424 is 764.17 g/mol.
Where can I buy Ro-23-9424?
You can request a quote for Ro-23-9424 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro-23-9424?
Yes, KEHONG BIO provides custom synthesis services for Ro-23-9424 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.