![1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] structure](/static/products/487/487036-75-9.png)
1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]
TL;DR: 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] (CAS 487036-75-9) is a chemical compound with molecular formula C29H31N3OS and molecular weight 469.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-phenylsulfanylphenyl)-1'-propan-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
Also Known As: 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine], 2'-[4-(phenylsulfanyl)phenyl]-1-(propan-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine], 2-(4-phenylsulfanylphenyl)-1'-propan-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]
| Molecular Formula | C29H31N3OS |
|---|---|
| Molecular Weight | 469.22 g/mol |
| LogP | 6.5818 |
| Topological Polar Surface Area | 28.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 469.21878 |
| Heavy Atoms | 34 |
| Complexity | 1183.5123 |
Chemical Identifiers
| CAS Number | 487036-75-9 |
|---|---|
| SMILES | CC(C)N1CCC2(CC1)N3C(CC(=N3)C4=CC=C(C=C4)SC5=CC=CC=C5)C6=CC=CC=C6O2 |
Product Overview
1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] (CAS 487036-75-9), with molecular formula C29H31N3OS and molecular weight 469.22 g/mol. IUPAC: 2-(4-phenylsulfanylphenyl)-1'-propan-2-ylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine].
Chemical Property Profile of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]
Property Insights of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]
The XLogP value of 6.5818 indicates that 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.07 Ų, 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] 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 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]?
The CAS number of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] is 487036-75-9.
What is the molecular formula of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]?
The molecular formula of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] is C29H31N3OS.
What is the molecular weight of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]?
The molecular weight of 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] is 469.22 g/mol.
Where can I buy 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]?
You can request a quote for 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine]?
Yes, KEHONG BIO provides custom synthesis services for 1'-isopropyl-2-(4-(phenylthio)phenyl)-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidine] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.