2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
TL;DR: 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine (CAS 302914-08-5) is a chemical compound with molecular formula C22H14BrCl2N3O3 and molecular weight 516.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)-7,9-dichloro-5-(3-nitrophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: 2-(4-bromophenyl)-7,9-dichloro-5-(3-nitrophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 2-(4-Bromophenyl)-7,9-dichloro-5-(3-nitrophenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine, 2-(4-bromophenyl)-7,9-dichloro-5-(3-nitrophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, 663-968-9
| Molecular Formula | C22H14BrCl2N3O3 |
|---|---|
| Molecular Weight | 516.96 g/mol |
| LogP | 6.9064 |
| Topological Polar Surface Area | 67.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 516.95953 |
| Heavy Atoms | 31 |
| Complexity | 1233.1708 |
Chemical Identifiers
| CAS Number | 302914-08-5 |
|---|---|
| SMILES | C1C2C3=C(C(=CC(=C3)Cl)Cl)OC(N2N=C1C4=CC=C(C=C4)Br)C5=CC(=CC=C5)[N+](=O)[O-] |
Product Overview
2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine (CAS 302914-08-5), with molecular formula C22H14BrCl2N3O3 and molecular weight 516.96 g/mol. IUPAC: 2-(4-bromophenyl)-7,9-dichloro-5-(3-nitrophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
Property Insights of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
The XLogP value of 6.9064 indicates that 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine. Following Lipinski's Rule of Five, 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
The CAS number of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is 302914-08-5.
What is the molecular formula of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
The molecular formula of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is C22H14BrCl2N3O3.
What is the molecular weight of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
The molecular weight of 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is 516.96 g/mol.
Where can I buy 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
You can request a quote for 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-BR-PH)-7,9-DI-CL-5-(3-Nitro-PH)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.