F0920-5289
TL;DR: F0920-5289 (CAS 685869-13-0) is a chemical compound with molecular formula C21H17N3O5S and molecular weight 423.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-oxo-2-[3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanoylamino]isoquinoline-4-carboxylate
Also Known As: F0920-5289, methyl 1-oxo-2-[3-(2-sulfanylidene-2,3-dihydro-1,3-benzoxazol-3-yl)propanamido]-1,2-dihydroisoquinoline-4-carboxylate, methyl 1-oxo-2-(3-(2-thioxobenzo[d]oxazol-3(2H)-yl)propanamido)-1,2-dihydroisoquinoline-4-carboxylate, methyl 1-oxo-2-[3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanoylamino]isoquinoline-4-carboxylate, Methyl 1-oxo-2-[3-(2-sulfanylidenebenzooxazol-3-yl)propanoylamino]isoquinoline-4-carboxylate
| Molecular Formula | C21H17N3O5S |
|---|---|
| Molecular Weight | 423.09 g/mol |
| LogP | 3.22569 |
| Topological Polar Surface Area | 95.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.0889 |
| Heavy Atoms | 30 |
| Complexity | 1399.2992 |
Chemical Identifiers
| CAS Number | 685869-13-0 |
|---|---|
| SMILES | COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)CCN3C4=CC=CC=C4OC3=S |
Product Overview
F0920-5289 (CAS 685869-13-0), with molecular formula C21H17N3O5S and molecular weight 423.09 g/mol. IUPAC: methyl 1-oxo-2-[3-(2-sulfanylidene-1,3-benzoxazol-3-yl)propanoylamino]isoquinoline-4-carboxylate.
Chemical Property Profile of F0920-5289
Property Insights of F0920-5289
The XLogP value of 3.22569 indicates that F0920-5289 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.47 Ų falls within the moderate polarity range, balancing permeability and solubility for F0920-5289. Following Lipinski's Rule of Five, F0920-5289 has 1 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 F0920-5289?
The CAS number of F0920-5289 is 685869-13-0.
What is the molecular formula of F0920-5289?
The molecular formula of F0920-5289 is C21H17N3O5S.
What is the molecular weight of F0920-5289?
The molecular weight of F0920-5289 is 423.09 g/mol.
Where can I buy F0920-5289?
You can request a quote for F0920-5289 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0920-5289?
Yes, KEHONG BIO provides custom synthesis services for F0920-5289 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.