BAS 02563254
TL;DR: BAS 02563254 (CAS 333412-07-0) is a chemical compound with molecular formula C21H23N5O6S and molecular weight 473.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-3-nitrophenyl)-2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02563254, N-{3-nitro-4-methylphenyl}-2-({4-methyl-5-[3,4,5-tris(methyloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(4-methyl-3-nitrophenyl)-2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-methyl-3-nitrophenyl)-2-[4-methyl-5-(3,4,5-trimethoxyphenyl)(1,2,4-triazo l-3-ylthio)]acetamide
| Molecular Formula | C21H23N5O6S |
|---|---|
| Molecular Weight | 473.14 g/mol |
| LogP | 3.45532 |
| Topological Polar Surface Area | 130.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 473.1369 |
| Heavy Atoms | 33 |
| Complexity | 1170.8787 |
Chemical Identifiers
| CAS Number | 333412-07-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC(=C(C(=C3)OC)OC)OC)[N+](=O)[O-] |
Product Overview
BAS 02563254 (CAS 333412-07-0), with molecular formula C21H23N5O6S and molecular weight 473.14 g/mol. IUPAC: N-(4-methyl-3-nitrophenyl)-2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02563254
Property Insights of BAS 02563254
The XLogP value of 3.45532 indicates that BAS 02563254 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02563254. Following Lipinski's Rule of Five, BAS 02563254 has 1 hydrogen bond donor(s) and 9 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 02563254?
The CAS number of BAS 02563254 is 333412-07-0.
What is the molecular formula of BAS 02563254?
The molecular formula of BAS 02563254 is C21H23N5O6S.
What is the molecular weight of BAS 02563254?
The molecular weight of BAS 02563254 is 473.14 g/mol.
Where can I buy BAS 02563254?
You can request a quote for BAS 02563254 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02563254?
Yes, KEHONG BIO provides custom synthesis services for BAS 02563254 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.