BAS 02105404
TL;DR: BAS 02105404 (CAS 425401-43-0) is a chemical compound with molecular formula C23H20F3NO6S and molecular weight 495.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]-4,4,4-trifluoro-3-oxobutanoate
Also Known As: BAS 02105404, isopropyl 4,4,4-trifluoro-2-(1-hydroxy-4-(phenylsulfonamido)naphthalen-2-yl)-3-oxobutanoate, propan-2-yl 2-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]-4,4,4-trifluoro-3-oxobutanoate, BRD-A21840722-001-01-6, F0808-0235
| Molecular Formula | C23H20F3NO6S |
|---|---|
| Molecular Weight | 495.10 g/mol |
| LogP | 4.5128 |
| Topological Polar Surface Area | 109.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 495.09634 |
| Heavy Atoms | 34 |
| Complexity | 1338.0629 |
Chemical Identifiers
| CAS Number | 425401-43-0 |
|---|---|
| SMILES | CC(C)OC(=O)C(C1=C(C2=CC=CC=C2C(=C1)NS(=O)(=O)C3=CC=CC=C3)O)C(=O)C(F)(F)F |
Product Overview
BAS 02105404 (CAS 425401-43-0), with molecular formula C23H20F3NO6S and molecular weight 495.10 g/mol. IUPAC: propan-2-yl 2-[4-(benzenesulfonamido)-1-hydroxynaphthalen-2-yl]-4,4,4-trifluoro-3-oxobutanoate.
Chemical Property Profile of BAS 02105404
Property Insights of BAS 02105404
The XLogP value of 4.5128 indicates that BAS 02105404 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.77 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02105404. Following Lipinski's Rule of Five, BAS 02105404 has 2 hydrogen bond donor(s) and 6 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 02105404?
The CAS number of BAS 02105404 is 425401-43-0.
What is the molecular formula of BAS 02105404?
The molecular formula of BAS 02105404 is C23H20F3NO6S.
What is the molecular weight of BAS 02105404?
The molecular weight of BAS 02105404 is 495.10 g/mol.
Where can I buy BAS 02105404?
You can request a quote for BAS 02105404 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02105404?
Yes, KEHONG BIO provides custom synthesis services for BAS 02105404 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.