BAS 13403367
TL;DR: BAS 13403367 (CAS 878425-34-4) is a chemical compound with molecular formula C21H22FN5O2S and molecular weight 427.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-morpholin-4-ylphenyl)acetamide
Also Known As: BAS 13403367, 2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-morpholin-4-ylphenyl)acetamide, 2-{[5-(2-fluorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(morpholin-4-yl)phenyl]acetamide, 2-[5-(2-Fluoro-phenyl)-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl]-N-(4-morpholin-4-yl-phenyl)-acetamide
| Molecular Formula | C21H22FN5O2S |
|---|---|
| Molecular Weight | 427.15 g/mol |
| LogP | 3.1886 |
| Topological Polar Surface Area | 72.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.14783 |
| Heavy Atoms | 30 |
| Complexity | 1018.49115 |
Chemical Identifiers
| CAS Number | 878425-34-4 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)N3CCOCC3)C4=CC=CC=C4F |
Product Overview
BAS 13403367 (CAS 878425-34-4), with molecular formula C21H22FN5O2S and molecular weight 427.15 g/mol. IUPAC: 2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-morpholin-4-ylphenyl)acetamide.
Chemical Property Profile of BAS 13403367
Property Insights of BAS 13403367
The XLogP value of 3.1886 indicates that BAS 13403367 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.28 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13403367. Following Lipinski's Rule of Five, BAS 13403367 has 1 hydrogen bond donor(s) and 6 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 13403367?
The CAS number of BAS 13403367 is 878425-34-4.
What is the molecular formula of BAS 13403367?
The molecular formula of BAS 13403367 is C21H22FN5O2S.
What is the molecular weight of BAS 13403367?
The molecular weight of BAS 13403367 is 427.15 g/mol.
Where can I buy BAS 13403367?
You can request a quote for BAS 13403367 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13403367?
Yes, KEHONG BIO provides custom synthesis services for BAS 13403367 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.