![methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate structure](/static/products/840/840470-32-8.png)
methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
TL;DR: methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate (CAS 840470-32-8) is a chemical compound with molecular formula C26H23ClN2O4 and molecular weight 462.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
Also Known As: methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate, methyl 4-(9-chloro-7-methoxy-2-(p-tolyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)benzoate, methyl 4-[2-chloro-4-methoxy-9-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1 ,5-c]1,3-oxazin-6-yl]benzoate, methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
| Molecular Formula | C26H23ClN2O4 |
|---|---|
| Molecular Weight | 462.13 g/mol |
| LogP | 5.68592 |
| Topological Polar Surface Area | 60.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.13464 |
| Heavy Atoms | 33 |
| Complexity | 1238.3967 |
Chemical Identifiers
| CAS Number | 840470-32-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C(=CC(=C4)Cl)OC)OC3C5=CC=C(C=C5)C(=O)OC |
Product Overview
methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate (CAS 840470-32-8), with molecular formula C26H23ClN2O4 and molecular weight 462.13 g/mol. IUPAC: methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate.
Chemical Property Profile of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
Property Insights of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
The XLogP value of 5.68592 indicates that methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.36 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate. Following Lipinski's Rule of Five, methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate?
The CAS number of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate is 840470-32-8.
What is the molecular formula of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate?
The molecular formula of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate is C26H23ClN2O4.
What is the molecular weight of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate?
The molecular weight of methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate is 462.13 g/mol.
Where can I buy methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate?
You can request a quote for methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.