![1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone structure](/static/products/861/861630-40-2.png)
1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone
TL;DR: 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone (CAS 861630-40-2) is a chemical compound with molecular formula C23H24ClN3O2 and molecular weight 409.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-chlorophenyl)-7-methylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]-1'-yl]ethanone
Also Known As: 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone, 1-[2'-(4-chlorophenyl)-7'-methyl-1',10b'-dihydro-1H-spiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethanone, 1-[2-(4-chlorophenyl)-7-methylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]-1'-yl]ethanone
| Molecular Formula | C23H24ClN3O2 |
|---|---|
| Molecular Weight | 409.16 g/mol |
| LogP | 4.53052 |
| Topological Polar Surface Area | 45.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 409.1557 |
| Heavy Atoms | 29 |
| Complexity | 993.68256 |
Chemical Identifiers
| CAS Number | 861630-40-2 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C3CC(=NN3C4(O2)CCN(CC4)C(=O)C)C5=CC=C(C=C5)Cl |
Product Overview
1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone (CAS 861630-40-2), with molecular formula C23H24ClN3O2 and molecular weight 409.16 g/mol. IUPAC: 1-[2-(4-chlorophenyl)-7-methylspiro[1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine-5,4'-piperidine]-1'-yl]ethanone.
Chemical Property Profile of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone
Property Insights of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone
The XLogP value of 4.53052 indicates that 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.14 Ų, 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone?
The CAS number of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone is 861630-40-2.
What is the molecular formula of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone?
The molecular formula of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone is C23H24ClN3O2.
What is the molecular weight of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone?
The molecular weight of 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone is 409.16 g/mol.
Where can I buy 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone?
You can request a quote for 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(4-chlorophenyl)-7-methyl-1,10b-dihydrospiro[benzo[e]pyrazolo[1,5-c][1,3]oxazine-5,4'-piperidin]-1'-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.