BAS 02070443
TL;DR: BAS 02070443 (CAS 500211-68-7) is a chemical compound with molecular formula C24H20N6O5S and molecular weight 504.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-5-nitrophenyl)-2-[[4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02070443, N-(2-Methyl-5-nitro-phenyl)-2-[5-(4-nitro-phenyl)-4-p-tolyl-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide, N-(2-methyl-5-nitrophenyl)-2-[[4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C24H20N6O5S |
|---|---|
| Molecular Weight | 504.12 g/mol |
| LogP | 5.09834 |
| Topological Polar Surface Area | 146.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 504.12158 |
| Heavy Atoms | 36 |
| Complexity | 1451.111 |
Chemical Identifiers
| CAS Number | 500211-68-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
BAS 02070443 (CAS 500211-68-7), with molecular formula C24H20N6O5S and molecular weight 504.12 g/mol. IUPAC: N-(2-methyl-5-nitrophenyl)-2-[[4-(4-methylphenyl)-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02070443
Property Insights of BAS 02070443
The XLogP value of 5.09834 indicates that BAS 02070443 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.09 Ų indicates high polarity, suggesting BAS 02070443 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 02070443 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02070443?
The CAS number of BAS 02070443 is 500211-68-7.
What is the molecular formula of BAS 02070443?
The molecular formula of BAS 02070443 is C24H20N6O5S.
What is the molecular weight of BAS 02070443?
The molecular weight of BAS 02070443 is 504.12 g/mol.
Where can I buy BAS 02070443?
You can request a quote for BAS 02070443 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02070443?
Yes, KEHONG BIO provides custom synthesis services for BAS 02070443 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.