BAS 01377633
TL;DR: BAS 01377633 (CAS 113518-47-1) is a chemical compound with molecular formula C22H19N5OS and molecular weight 401.13104 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-methylphenyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 01377633, 2-((4-Phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(o-tolyl)acetamide, Acetamide, N-(2-methylphenyl)-2-((4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl)thio)-, o-Acetotoluidide, 2-((1-phenyl-5-(4-pyridyl)-1,3,4-triazol-2-yl)thio)-, N-(2-Methylphenyl)-2-((1-phenyl-5-(4-pyridinyl)-1H-1,3,4-triazol-2-yl)thio)acetamide
Technical Specifications
| Molecular Formula | C22H19N5OS |
| Molecular Weight | 401.13104 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 98.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.13104 Da |
| Heavy Atoms | 29 |
| Complexity | 523.0 |
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=NC=C4 |
| InChIKey | VDGVMKWFPVTEKR-UHFFFAOYSA-N |
Chemical Property Profile of BAS 01377633
Property Insights of BAS 01377633
The XLogP value of 3.8 indicates that BAS 01377633 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01377633. Following Lipinski's Rule of Five, BAS 01377633 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 01377633?
The CAS number of BAS 01377633 is 113518-47-1.
What is the molecular formula of BAS 01377633?
The molecular formula of BAS 01377633 is C22H19N5OS.
What is the molecular weight of BAS 01377633?
The molecular weight of BAS 01377633 is 401.13104 g/mol.
Where can I buy BAS 01377633?
You can request a quote for BAS 01377633 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 01377633?
Yes, CoreyChem provides custom synthesis services for BAS 01377633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.