BAS 01279962
TL;DR: BAS 01279962 (CAS 332175-50-5) is a chemical compound with molecular formula C20H19BrN4OS and molecular weight 442.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-4-methylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 01279962, 2-((4-Allyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(2-bromo-4-methylphenyl)acetamide, 2-(4-Allyl-5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(2-bromo-4-methyl-phenyl)-acetamide, N-(2-bromo-4-methylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C20H19BrN4OS |
|---|---|
| Molecular Weight | 442.05 g/mol |
| LogP | 4.93282 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.0463 |
| Heavy Atoms | 27 |
| Complexity | 955.8705 |
Chemical Identifiers
| CAS Number | 332175-50-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=C3)Br |
Product Overview
BAS 01279962 (CAS 332175-50-5), with molecular formula C20H19BrN4OS and molecular weight 442.05 g/mol. IUPAC: N-(2-bromo-4-methylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 01279962
Property Insights of BAS 01279962
The XLogP value of 4.93282 indicates that BAS 01279962 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, BAS 01279962 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01279962 has 1 hydrogen bond donor(s) and 4 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 01279962?
The CAS number of BAS 01279962 is 332175-50-5.
What is the molecular formula of BAS 01279962?
The molecular formula of BAS 01279962 is C20H19BrN4OS.
What is the molecular weight of BAS 01279962?
The molecular weight of BAS 01279962 is 442.05 g/mol.
Where can I buy BAS 01279962?
You can request a quote for BAS 01279962 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01279962?
Yes, KEHONG BIO provides custom synthesis services for BAS 01279962 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.