BAS 03200458
TL;DR: BAS 03200458 (CAS 485773-96-4) is a chemical compound with molecular formula C22H24N4O5S and molecular weight 456.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[5-[(2-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: BAS 03200458, ethyl 4-{[({5-[(2-methoxyphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate, ethyl 4-(2-((5-((2-methoxyphenoxy)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate, ethyl 4-[[2-[[5-[(2-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate, ethyl 4-{[({5-[(2-methoxyphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}thio)acetyl]amino}benzoate
| Molecular Formula | C22H24N4O5S |
|---|---|
| Molecular Weight | 456.15 g/mol |
| LogP | 3.3102 |
| Topological Polar Surface Area | 104.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 456.14673 |
| Heavy Atoms | 32 |
| Complexity | 1068.4381 |
Chemical Identifiers
| CAS Number | 485773-96-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)COC3=CC=CC=C3OC |
Product Overview
BAS 03200458 (CAS 485773-96-4), with molecular formula C22H24N4O5S and molecular weight 456.15 g/mol. IUPAC: ethyl 4-[[2-[[5-[(2-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of BAS 03200458
Property Insights of BAS 03200458
The XLogP value of 3.3102 indicates that BAS 03200458 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03200458. Following Lipinski's Rule of Five, BAS 03200458 has 1 hydrogen bond donor(s) and 8 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 03200458?
The CAS number of BAS 03200458 is 485773-96-4.
What is the molecular formula of BAS 03200458?
The molecular formula of BAS 03200458 is C22H24N4O5S.
What is the molecular weight of BAS 03200458?
The molecular weight of BAS 03200458 is 456.15 g/mol.
Where can I buy BAS 03200458?
You can request a quote for BAS 03200458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03200458?
Yes, KEHONG BIO provides custom synthesis services for BAS 03200458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.