9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
TL;DR: 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine (CAS 477333-58-7) is a chemical compound with molecular formula C22H17ClFN3O and molecular weight 393.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-2-(4-fluorophenyl)-5-methyl-5-pyridin-4-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Also Known As: 9-chloro-2-(4-fluorophenyl)-5-methyl-5-pyridin-4-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 9-chloro-2-(4-fluorophenyl)-5-methyl-5-(4-pyridinyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 9-Chloro-2-(4-fluorophenyl)-5-methyl-5-(pyridin-4-yl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine, 649-963-4
| Molecular Formula | C22H17ClFN3O |
|---|---|
| Molecular Weight | 393.10 g/mol |
| LogP | 5.2905 |
| Topological Polar Surface Area | 37.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 393.10443 |
| Heavy Atoms | 28 |
| Complexity | 1070.8998 |
Chemical Identifiers
| CAS Number | 477333-58-7 |
|---|---|
| SMILES | CC1(N2C(CC(=N2)C3=CC=C(C=C3)F)C4=C(O1)C=CC(=C4)Cl)C5=CC=NC=C5 |
Product Overview
9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine (CAS 477333-58-7), with molecular formula C22H17ClFN3O and molecular weight 393.10 g/mol. IUPAC: 9-chloro-2-(4-fluorophenyl)-5-methyl-5-pyridin-4-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
Property Insights of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
The XLogP value of 5.2905 indicates that 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.72 Ų, 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine 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 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
The CAS number of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is 477333-58-7.
What is the molecular formula of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
The molecular formula of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is C22H17ClFN3O.
What is the molecular weight of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
The molecular weight of 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is 393.10 g/mol.
Where can I buy 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
You can request a quote for 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 9-CL-2-(4-F-PH)5-ME-5-(4-Pyridinyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.