BAS 08845863
TL;DR: BAS 08845863 (CAS 708289-33-2) is a chemical compound with molecular formula C20H21FN4O3S and molecular weight 416.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-fluoro-2-methylphenyl)-2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 08845863, N-(5-fluoro-2-methylphenyl)-2-({5-[(4-methoxyphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(5-fluoro-2-methylphenyl)-2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C20H21FN4O3S |
|---|---|
| Molecular Weight | 416.13 g/mol |
| LogP | 3.58102 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 416.13184 |
| Heavy Atoms | 29 |
| Complexity | 991.8914 |
Chemical Identifiers
| CAS Number | 708289-33-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)F)NC(=O)CSC2=NN=C(N2C)COC3=CC=C(C=C3)OC |
Product Overview
BAS 08845863 (CAS 708289-33-2), with molecular formula C20H21FN4O3S and molecular weight 416.13 g/mol. IUPAC: N-(5-fluoro-2-methylphenyl)-2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 08845863
Property Insights of BAS 08845863
The XLogP value of 3.58102 indicates that BAS 08845863 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08845863. Following Lipinski's Rule of Five, BAS 08845863 has 1 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 08845863?
The CAS number of BAS 08845863 is 708289-33-2.
What is the molecular formula of BAS 08845863?
The molecular formula of BAS 08845863 is C20H21FN4O3S.
What is the molecular weight of BAS 08845863?
The molecular weight of BAS 08845863 is 416.13 g/mol.
Where can I buy BAS 08845863?
You can request a quote for BAS 08845863 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08845863?
Yes, KEHONG BIO provides custom synthesis services for BAS 08845863 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.