5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
TL;DR: 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine (CAS 383902-83-8) is a chemical compound with molecular formula C28H27BrN2O3 and molecular weight 518.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-bromo-2-(4-propan-2-yloxyphenyl)-5-(4-prop-2-enoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 9-bromo-2-(4-propan-2-yloxyphenyl)-5-(4-prop-2-enoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, 9-bromo-2-[4-(propan-2-yloxy)phenyl]-5-[4-(prop-2-en-1-yloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C28H27BrN2O3 |
|---|---|
| Molecular Weight | 518.12 g/mol |
| LogP | 7.0434 |
| Topological Polar Surface Area | 43.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.1205 |
| Heavy Atoms | 34 |
| Complexity | 1205.3258 |
Chemical Identifiers
| CAS Number | 383902-83-8 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Br)OC3C5=CC=C(C=C5)OCC=C |
Product Overview
5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine (CAS 383902-83-8), with molecular formula C28H27BrN2O3 and molecular weight 518.12 g/mol. IUPAC: 9-bromo-2-(4-propan-2-yloxyphenyl)-5-(4-prop-2-enoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
Property Insights of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
The XLogP value of 7.0434 indicates that 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.29 Ų, 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine 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 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine?
The CAS number of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine is 383902-83-8.
What is the molecular formula of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine?
The molecular formula of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine is C28H27BrN2O3.
What is the molecular weight of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine?
The molecular weight of 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine is 518.12 g/mol.
Where can I buy 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine?
You can request a quote for 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-(allyloxy)phenyl)-9-bromo-2-(4-isopropoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.