Ro 14-1761
TL;DR: Ro 14-1761 (CAS 82502-19-0) is a chemical compound with molecular formula C17H16N8O7S3 and molecular weight 540.03 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-hydroxyiminoacetyl]amino]-3-[(2-methyl-5,6-dioxo-1H-1,2,4-triazin-3-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Ro 14-1761
| Molecular Formula | C17H16N8O7S3 |
|---|---|
| Molecular Weight | 540.03 g/mol |
| LogP | -1.7835 |
| Topological Polar Surface Area | 225.96 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 540.0304 |
| Heavy Atoms | 35 |
| Complexity | 1410.7506 |
Chemical Identifiers
| CAS Number | 82502-19-0 |
|---|---|
| SMILES | CN1C(=NC(=O)C(=O)N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\O)/C4=CSC(=N4)N)SC2)C(=O)O |
Product Overview
Ro 14-1761 (CAS 82502-19-0), with molecular formula C17H16N8O7S3 and molecular weight 540.03 g/mol. IUPAC: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetyl]amino]-3-[(2-methyl-5,6-dioxo-1H-1,2,4-triazin-3-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Ro 14-1761
Property Insights of Ro 14-1761
The XLogP value of -1.7835 indicates that Ro 14-1761 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.96 Ų indicates high polarity, suggesting Ro 14-1761 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ro 14-1761 has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ro 14-1761?
The CAS number of Ro 14-1761 is 82502-19-0.
What is the molecular formula of Ro 14-1761?
The molecular formula of Ro 14-1761 is C17H16N8O7S3.
What is the molecular weight of Ro 14-1761?
The molecular weight of Ro 14-1761 is 540.03 g/mol.
Where can I buy Ro 14-1761?
You can request a quote for Ro 14-1761 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 14-1761?
Yes, KEHONG BIO provides custom synthesis services for Ro 14-1761 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.