![methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate structure](/static/products/577/577696-09-4.png)
methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate
TL;DR: methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate (CAS 577696-09-4) is a chemical compound with molecular formula C24H19N3O5 and molecular weight 429.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(9-nitro-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate
Also Known As: methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate, methyl 4-(9-nitro-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate, methyl 4-(9-nitro-2-phenyl-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazin-5-yl)benzoate
| Molecular Formula | C24H19N3O5 |
|---|---|
| Molecular Weight | 429.13 g/mol |
| LogP | 4.6237 |
| Topological Polar Surface Area | 94.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.13248 |
| Heavy Atoms | 32 |
| Complexity | 1224.142 |
Chemical Identifiers
| CAS Number | 577696-09-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CC=C4)C5=C(O2)C=CC(=C5)[N+](=O)[O-] |
Product Overview
methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate (CAS 577696-09-4), with molecular formula C24H19N3O5 and molecular weight 429.13 g/mol. IUPAC: methyl 4-(9-nitro-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate.
Chemical Property Profile of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate
Property Insights of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate
The XLogP value of 4.6237 indicates that methyl 4-(9-nitro-2-phenyl-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 94.27 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate. Following Lipinski's Rule of Five, methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate has 0 hydrogen bond donor(s) and 7 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 methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate?
The CAS number of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate is 577696-09-4.
What is the molecular formula of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate?
The molecular formula of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate is C24H19N3O5.
What is the molecular weight of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate?
The molecular weight of methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate is 429.13 g/mol.
Where can I buy methyl 4-(9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate?
You can request a quote for methyl 4-(9-nitro-2-phenyl-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-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(9-nitro-2-phenyl-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.