BAS 00889839
TL;DR: BAS 00889839 (CAS 332060-54-5) is a chemical compound with molecular formula C22H15Cl2FN2O and molecular weight 412.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: BAS 00889839, 9-chloro-2-(4-chlorophenyl)-5-(4-fluorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 9-chloro-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine, 8-CL-2-(4-CL-PH)-4-(4-F-PH)-1,9B-2H-5-OXA-3,3A-DIAZA-CYCLOPENTA(A)NAPHTHALENE
| Molecular Formula | C22H15Cl2FN2O |
|---|---|
| Molecular Weight | 412.05 g/mol |
| LogP | 6.3748 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 412.05453 |
| Heavy Atoms | 28 |
| Complexity | 1066.8998 |
Chemical Identifiers
| CAS Number | 332060-54-5 |
|---|---|
| SMILES | C1C2C3=C(C=CC(=C3)Cl)OC(N2N=C1C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)F |
Product Overview
BAS 00889839 (CAS 332060-54-5), with molecular formula C22H15Cl2FN2O and molecular weight 412.05 g/mol. IUPAC: 9-chloro-2-(4-chlorophenyl)-5-(4-fluorophenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine.
Chemical Property Profile of BAS 00889839
Property Insights of BAS 00889839
The XLogP value of 6.3748 indicates that BAS 00889839 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, BAS 00889839 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00889839 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 BAS 00889839?
The CAS number of BAS 00889839 is 332060-54-5.
What is the molecular formula of BAS 00889839?
The molecular formula of BAS 00889839 is C22H15Cl2FN2O.
What is the molecular weight of BAS 00889839?
The molecular weight of BAS 00889839 is 412.05 g/mol.
Where can I buy BAS 00889839?
You can request a quote for BAS 00889839 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00889839?
Yes, KEHONG BIO provides custom synthesis services for BAS 00889839 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.