F1589-0863
TL;DR: F1589-0863 (CAS 627889-50-3) is a chemical compound with molecular formula C22H18BrN3O and molecular weight 419.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-bromo-2-(4-methylphenyl)-5-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: F1589-0863, 9-bromo-5-(pyridin-3-yl)-2-(p-tolyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 12-bromo-4-(4-methylphenyl)-7-(pyridin-3-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0^{2,6}]trideca-1(9),4,10,12-tetraene, 9-bromo-2-(4-methylphenyl)-5-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, 9-bromo-2-(4-methylphenyl)-5-(pyridin-3-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C22H18BrN3O |
|---|---|
| Molecular Weight | 419.06 g/mol |
| LogP | 5.39482 |
| Topological Polar Surface Area | 37.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 419.06332 |
| Heavy Atoms | 27 |
| Complexity | 1017.4877 |
Chemical Identifiers
| CAS Number | 627889-50-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC3C5=CN=CC=C5 |
Product Overview
F1589-0863 (CAS 627889-50-3), with molecular formula C22H18BrN3O and molecular weight 419.06 g/mol. IUPAC: 9-bromo-2-(4-methylphenyl)-5-pyridin-3-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of F1589-0863
Property Insights of F1589-0863
The XLogP value of 5.39482 indicates that F1589-0863 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.72 Ų, F1589-0863 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1589-0863 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1589-0863?
The CAS number of F1589-0863 is 627889-50-3.
What is the molecular formula of F1589-0863?
The molecular formula of F1589-0863 is C22H18BrN3O.
What is the molecular weight of F1589-0863?
The molecular weight of F1589-0863 is 419.06 g/mol.
Where can I buy F1589-0863?
You can request a quote for F1589-0863 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1589-0863?
Yes, KEHONG BIO provides custom synthesis services for F1589-0863 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.