BAS 05160854
TL;DR: BAS 05160854 (CAS 328019-71-2) is a chemical compound with molecular formula C19H15ClF3NO3 and molecular weight 397.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)chromen-4-one
Also Known As: BAS 05160854, 3-(2-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one, AE-641/40790016, 3-(2-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)chromen-4-one, 3-(2-Chloro-phenyl)-8-dimethylaminomethyl-7-hydroxy-2-trifluoromethyl-chromen-4-one
| Molecular Formula | C19H15ClF3NO3 |
|---|---|
| Molecular Weight | 397.07 g/mol |
| LogP | 4.8994 |
| Topological Polar Surface Area | 53.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.06924 |
| Heavy Atoms | 27 |
| Complexity | 1074.2085 |
Chemical Identifiers
| CAS Number | 328019-71-2 |
|---|---|
| SMILES | CN(C)CC1=C(C=CC2=C1OC(=C(C2=O)C3=CC=CC=C3Cl)C(F)(F)F)O |
Product Overview
BAS 05160854 (CAS 328019-71-2), with molecular formula C19H15ClF3NO3 and molecular weight 397.07 g/mol. IUPAC: 3-(2-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-2-(trifluoromethyl)chromen-4-one.
Chemical Property Profile of BAS 05160854
Property Insights of BAS 05160854
The XLogP value of 4.8994 indicates that BAS 05160854 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.68 Ų, BAS 05160854 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 05160854 has 1 hydrogen bond donor(s) and 4 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 05160854?
The CAS number of BAS 05160854 is 328019-71-2.
What is the molecular formula of BAS 05160854?
The molecular formula of BAS 05160854 is C19H15ClF3NO3.
What is the molecular weight of BAS 05160854?
The molecular weight of BAS 05160854 is 397.07 g/mol.
Where can I buy BAS 05160854?
You can request a quote for BAS 05160854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05160854?
Yes, KEHONG BIO provides custom synthesis services for BAS 05160854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.