![2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene structure](/static/products/671/671763-62-5.png)
2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene
TL;DR: 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene (CAS 671763-62-5) is a chemical compound with molecular formula C21H16Br2N2OS and molecular weight 501.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dibromo-5-(4-methylphenyl)-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene, 7,9-DI-BR-5-(4-ME-PH)-2-(2-THIENYL)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZINE, 7,9-dibromo-2-(thiophen-2-yl)-5-(p-tolyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 7,9-dibromo-5-(4-methylphenyl)-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 7,9-dibromo-5-(4-methylphenyl)-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C21H16Br2N2OS |
|---|---|
| Molecular Weight | 501.94 g/mol |
| LogP | 6.82382 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 501.935 |
| Heavy Atoms | 27 |
| Complexity | 1031.0901 |
Chemical Identifiers
| CAS Number | 671763-62-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C(=CC(=C5)Br)Br |
Product Overview
2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene (CAS 671763-62-5), with molecular formula C21H16Br2N2OS and molecular weight 501.94 g/mol. IUPAC: 7,9-dibromo-5-(4-methylphenyl)-2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene
Property Insights of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene
The XLogP value of 6.82382 indicates that 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene?
The CAS number of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene is 671763-62-5.
What is the molecular formula of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene?
The molecular formula of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene is C21H16Br2N2OS.
What is the molecular weight of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene?
The molecular weight of 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene is 501.94 g/mol.
Where can I buy 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene?
You can request a quote for 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-[2,4-dibromo-6-(4-methylphenyl)-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazi n-9-yl]thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.