A3559/0150947
TL;DR: A3559/0150947 (CAS 385389-77-5) is a chemical compound with molecular formula C22H14Br2ClFN2O and molecular weight 533.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dibromo-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: A3559/0150947, 7,9-dibromo-2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 7,9-dibromo-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 7,9-dibromo-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C22H14Br2ClFN2O |
|---|---|
| Molecular Weight | 533.91 g/mol |
| LogP | 7.2464 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 533.91455 |
| Heavy Atoms | 29 |
| Complexity | 1118.9062 |
Chemical Identifiers
| CAS Number | 385389-77-5 |
|---|---|
| SMILES | C1C2C3=C(C(=CC(=C3)Br)Br)OC(N2N=C1C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)F |
Product Overview
A3559/0150947 (CAS 385389-77-5), with molecular formula C22H14Br2ClFN2O and molecular weight 533.91 g/mol. IUPAC: 7,9-dibromo-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of A3559/0150947
Property Insights of A3559/0150947
The XLogP value of 7.2464 indicates that A3559/0150947 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, A3559/0150947 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3559/0150947 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3559/0150947?
The CAS number of A3559/0150947 is 385389-77-5.
What is the molecular formula of A3559/0150947?
The molecular formula of A3559/0150947 is C22H14Br2ClFN2O.
What is the molecular weight of A3559/0150947?
The molecular weight of A3559/0150947 is 533.91 g/mol.
Where can I buy A3559/0150947?
You can request a quote for A3559/0150947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3559/0150947?
Yes, KEHONG BIO provides custom synthesis services for A3559/0150947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.