Ro 25-0534
TL;DR: Ro 25-0534 (CAS 143488-32-8) is a chemical compound with molecular formula C41H41FN10O12S2 and molecular weight 948.2331 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[1-[2-(3,4-dihydroxybenzoyl)hydrazinyl]-2-methyl-1-oxopropan-2-yl]oxyiminoacetyl]amino]-3-[[4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxoquinolin-7-yl)piperazin-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Ro 25-0534, Ro-25-0534, (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[1-[2-(3,4-dihydroxybenzoyl)hydrazinyl]-2-methyl-1-oxopropan-2-yl]oxyiminoacetyl]amino]-3-[[4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxoquinolin-7-yl)piperazin-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2Z)-(2-amino-4-thiazolyl)((2-(2-(3,4-dihydroxybenzoyl)hydrazino)-1,1-dimethyl-2-oxoethoxy)imino)acetyl)amino)-3-((4-(3-carboxy-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-quinolinyl)-1-piperazinyl)methyl)-8-oxo-, 6R,7R)-, 7-(4-{[(6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[({1-[(3,4-dihydroxyphenyl)formohydrazido]-2-methyl-1-oxopropan-2-yl}oxy)imino]acetamido]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}piperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Technical Specifications
| Molecular Formula | C41H41FN10O12S2 |
| Molecular Weight | 948.2331 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 364.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 13 |
| Exact Mass | 948.2331 Da |
| Heavy Atoms | 66 |
| Complexity | 2100.0 |
| SMILES | CC(C)(C(=O)NNC(=O)C1=CC(=C(C=C1)O)O)O/N=C(/C2=CSC(=N2)N)\C(=O)N[C@H]3[C@@H]4N(C3=O)C(=C(CS4)CN5CCN(CC5)C6=C(C=C7C(=C6)N(C=C(C7=O)C(=O)O)C8CC8)F)C(=O)O |
| InChIKey | IXDFVVUXTFRFQQ-MOSWNVLFSA-N |
Chemical Property Profile of Ro 25-0534
Property Insights of Ro 25-0534
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ro 25-0534. The TPSA of 364.0 Ų indicates high polarity, suggesting Ro 25-0534 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ro 25-0534 has 8 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ro 25-0534?
The CAS number of Ro 25-0534 is 143488-32-8.
What is the molecular formula of Ro 25-0534?
The molecular formula of Ro 25-0534 is C41H41FN10O12S2.
What is the molecular weight of Ro 25-0534?
The molecular weight of Ro 25-0534 is 948.2331 g/mol.
Where can I buy Ro 25-0534?
You can request a quote for Ro 25-0534 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ro 25-0534?
Yes, CoreyChem provides custom synthesis services for Ro 25-0534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.