![9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] structure](/static/products/840/840476-22-4.png)
9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
TL;DR: 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] (CAS 840476-22-4) is a chemical compound with molecular formula C24H26BrF2N3O2 and molecular weight 505.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-bromo-2-[4-(difluoromethoxy)phenyl]-1'-propan-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Also Known As: 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine], 9-bromo-2-(4-(difluoromethoxy)phenyl)-1'-isopropyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine], 9-bromo-2-[4-(difluoromethoxy)phenyl]-1'-propan-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
| Molecular Formula | C24H26BrF2N3O2 |
|---|---|
| Molecular Weight | 505.12 g/mol |
| LogP | 5.7945 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 505.11765 |
| Heavy Atoms | 32 |
| Complexity | 1020.4044 |
Chemical Identifiers
| CAS Number | 840476-22-4 |
|---|---|
| SMILES | CC(C)N1CCC2(CC1)N3C(CC(=N3)C4=CC=C(C=C4)OC(F)F)C5=C(O2)C=CC(=C5)Br |
Product Overview
9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] (CAS 840476-22-4), with molecular formula C24H26BrF2N3O2 and molecular weight 505.12 g/mol. IUPAC: 9-bromo-2-[4-(difluoromethoxy)phenyl]-1'-propan-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine].
Chemical Property Profile of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Property Insights of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
The XLogP value of 5.7945 indicates that 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[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 37.3 Ų, 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]?
The CAS number of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] is 840476-22-4.
What is the molecular formula of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]?
The molecular formula of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] is C24H26BrF2N3O2.
What is the molecular weight of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]?
The molecular weight of 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] is 505.12 g/mol.
Where can I buy 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]?
You can request a quote for 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[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'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]?
Yes, KEHONG BIO provides custom synthesis services for 9'-bromo-2'-[4-(difluoromethoxy)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.