F1589-0614
TL;DR: F1589-0614 (CAS 452052-23-2) is a chemical compound with molecular formula C22H17ClN2O4 and molecular weight 408.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[9-chloro-2-(furan-2-yl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
Also Known As: F1589-0614, methyl 4-[9-chloro-2-(2-furyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate, methyl 4-(9-chloro-2-(furan-2-yl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)benzoate, methyl 4-[12-chloro-4-(furan-2-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0^{2,6}]trideca-1(9),4,10,12-tetraen-7-yl]benzoate, methyl 4-[9-chloro-2-(furan-2-yl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
| Molecular Formula | C22H17ClN2O4 |
|---|---|
| Molecular Weight | 408.09 g/mol |
| LogP | 4.9619 |
| Topological Polar Surface Area | 64.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.08768 |
| Heavy Atoms | 29 |
| Complexity | 1092.5099 |
Chemical Identifiers
| CAS Number | 452052-23-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CO4)C5=C(O2)C=CC(=C5)Cl |
Product Overview
F1589-0614 (CAS 452052-23-2), with molecular formula C22H17ClN2O4 and molecular weight 408.09 g/mol. IUPAC: methyl 4-[9-chloro-2-(furan-2-yl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate.
Chemical Property Profile of F1589-0614
Property Insights of F1589-0614
The XLogP value of 4.9619 indicates that F1589-0614 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.27 Ų falls within the moderate polarity range, balancing permeability and solubility for F1589-0614. Following Lipinski's Rule of Five, F1589-0614 has 0 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 F1589-0614?
The CAS number of F1589-0614 is 452052-23-2.
What is the molecular formula of F1589-0614?
The molecular formula of F1589-0614 is C22H17ClN2O4.
What is the molecular weight of F1589-0614?
The molecular weight of F1589-0614 is 408.09 g/mol.
Where can I buy F1589-0614?
You can request a quote for F1589-0614 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1589-0614?
Yes, KEHONG BIO provides custom synthesis services for F1589-0614 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.