BAS 02054458
TL;DR: BAS 02054458 (CAS 482636-88-4) is a chemical compound with molecular formula C18H19N5O3S and molecular weight 385.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 02054458, N-(2,5-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2,5-dimethoxyphenyl)-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N~1~-(2,5-DIMETHOXYPHENYL)-2-{[4-METHYL-5-(4-PYRIDYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE
| Molecular Formula | C18H19N5O3S |
|---|---|
| Molecular Weight | 385.12 g/mol |
| LogP | 2.6251 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.12085 |
| Heavy Atoms | 27 |
| Complexity | 930.00146 |
Chemical Identifiers
| CAS Number | 482636-88-4 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)OC)OC)C3=CC=NC=C3 |
Product Overview
BAS 02054458 (CAS 482636-88-4), with molecular formula C18H19N5O3S and molecular weight 385.12 g/mol. IUPAC: N-(2,5-dimethoxyphenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 02054458
Property Insights of BAS 02054458
The XLogP value of 2.6251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02054458. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02054458. Following Lipinski's Rule of Five, BAS 02054458 has 1 hydrogen bond donor(s) and 7 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 02054458?
The CAS number of BAS 02054458 is 482636-88-4.
What is the molecular formula of BAS 02054458?
The molecular formula of BAS 02054458 is C18H19N5O3S.
What is the molecular weight of BAS 02054458?
The molecular weight of BAS 02054458 is 385.12 g/mol.
Where can I buy BAS 02054458?
You can request a quote for BAS 02054458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02054458?
Yes, KEHONG BIO provides custom synthesis services for BAS 02054458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.