BAS 02539502
TL;DR: BAS 02539502 (CAS 351365-03-2) is a chemical compound with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide
Also Known As: BAS 02539502, 2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide, 2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide, 2-((5-(4-(tert-butyl)phenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-methoxyphenyl)acetamide, 2-{5-[4-(tert-butyl)phenyl]-4-(4-methylphenyl)(1,2,4-triazol-3-ylthio)}-N-(2-m ethoxyphenyl)acetamide
| Molecular Formula | C28H30N4O2S |
|---|---|
| Molecular Weight | 486.21 g/mol |
| LogP | 6.27962 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.20895 |
| Heavy Atoms | 35 |
| Complexity | 1306.2943 |
Chemical Identifiers
| CAS Number | 351365-03-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3OC)C4=CC=C(C=C4)C(C)(C)C |
Product Overview
BAS 02539502 (CAS 351365-03-2), with molecular formula C28H30N4O2S and molecular weight 486.21 g/mol. IUPAC: 2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide.
Chemical Property Profile of BAS 02539502
Property Insights of BAS 02539502
The XLogP value of 6.27962 indicates that BAS 02539502 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02539502. Following Lipinski's Rule of Five, BAS 02539502 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02539502?
The CAS number of BAS 02539502 is 351365-03-2.
What is the molecular formula of BAS 02539502?
The molecular formula of BAS 02539502 is C28H30N4O2S.
What is the molecular weight of BAS 02539502?
The molecular weight of BAS 02539502 is 486.21 g/mol.
Where can I buy BAS 02539502?
You can request a quote for BAS 02539502 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02539502?
Yes, KEHONG BIO provides custom synthesis services for BAS 02539502 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.