6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
TL;DR: 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid (CAS 385388-49-8) is a chemical compound with molecular formula C26H24N2O7 and molecular weight 476.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(4-hydroxy-3-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
Also Known As: 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid, 2,3-dimethoxy-6-[(2Z)-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,5,10b-tetrahydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoic acid, 2,3-dimethoxy-6-[2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1,3,5,10b-tetrahydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoic acid, 6-(2-(4-hydroxy-3-methoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)-2,3-dimethoxybenzoic acid
| Molecular Formula | C26H24N2O7 |
|---|---|
| Molecular Weight | 476.16 g/mol |
| LogP | 4.3585 |
| Topological Polar Surface Area | 110.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.15836 |
| Heavy Atoms | 35 |
| Complexity | 1337.2708 |
Chemical Identifiers
| CAS Number | 385388-49-8 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C2N3C(CC(=N3)C4=CC(=C(C=C4)O)OC)C5=CC=CC=C5O2)C(=O)O)OC |
Product Overview
6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid (CAS 385388-49-8), with molecular formula C26H24N2O7 and molecular weight 476.16 g/mol. IUPAC: 6-[2-(4-hydroxy-3-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid.
Chemical Property Profile of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
Property Insights of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid
The XLogP value of 4.3585 indicates that 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid has 2 hydrogen bond donor(s) and 8 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 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid?
The CAS number of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid is 385388-49-8.
What is the molecular formula of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid?
The molecular formula of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid is C26H24N2O7.
What is the molecular weight of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid?
The molecular weight of 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid is 476.16 g/mol.
Where can I buy 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid?
You can request a quote for 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-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-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-[2-(4-hydroxy-3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]-2,3-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.