6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid
TL;DR: 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid (CAS 861820-62-4) is a chemical compound with molecular formula C28H28N2O6 and molecular weight 488.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
Also Known As: 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid, 6-[2-(2,5-dimethylphenyl)-7-methoxy-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid, 6-[2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
| Molecular Formula | C28H28N2O6 |
|---|---|
| Molecular Weight | 488.19 g/mol |
| LogP | 5.26974 |
| Topological Polar Surface Area | 89.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 488.19473 |
| Heavy Atoms | 36 |
| Complexity | 1382.6931 |
Chemical Identifiers
| CAS Number | 861820-62-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C2=NN3C(C2)C4=C(C(=CC=C4)OC)OC3C5=C(C(=C(C=C5)OC)OC)C(=O)O |
Product Overview
6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid (CAS 861820-62-4), with molecular formula C28H28N2O6 and molecular weight 488.19 g/mol. IUPAC: 6-[2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid.
Chemical Property Profile of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid
Property Insights of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid
The XLogP value of 5.26974 indicates that 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid?
The CAS number of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid is 861820-62-4.
What is the molecular formula of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid?
The molecular formula of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid is C28H28N2O6.
What is the molecular weight of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid?
The molecular weight of 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid is 488.19 g/mol.
Where can I buy 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid?
You can request a quote for 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-(2,5-dimethylphenyl)-7-methoxy-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.