BAS 02286193
TL;DR: BAS 02286193 (CAS 347321-53-3) is a chemical compound with molecular formula C21H22F3N3O6 and molecular weight 469.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone
Also Known As: BAS 02286193, AB00104827-01, [4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone, {4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone, 4-[2-nitro-4-(trifluoromethyl)phenyl]piperazinyl 3,4,5-trimethoxyphenyl ketone
| Molecular Formula | C21H22F3N3O6 |
|---|---|
| Molecular Weight | 469.15 g/mol |
| LogP | 3.6018 |
| Topological Polar Surface Area | 94.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.14606 |
| Heavy Atoms | 33 |
| Complexity | 1027.0211 |
Chemical Identifiers
| CAS Number | 347321-53-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-] |
Product Overview
BAS 02286193 (CAS 347321-53-3), with molecular formula C21H22F3N3O6 and molecular weight 469.15 g/mol. IUPAC: [4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone.
Chemical Property Profile of BAS 02286193
Property Insights of BAS 02286193
The XLogP value of 3.6018 indicates that BAS 02286193 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.38 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02286193. Following Lipinski's Rule of Five, BAS 02286193 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 BAS 02286193?
The CAS number of BAS 02286193 is 347321-53-3.
What is the molecular formula of BAS 02286193?
The molecular formula of BAS 02286193 is C21H22F3N3O6.
What is the molecular weight of BAS 02286193?
The molecular weight of BAS 02286193 is 469.15 g/mol.
Where can I buy BAS 02286193?
You can request a quote for BAS 02286193 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02286193?
Yes, KEHONG BIO provides custom synthesis services for BAS 02286193 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.