BAS 01810179
TL;DR: BAS 01810179 (CAS 315231-46-0) is a chemical compound with molecular formula C26H25ClN6OS and molecular weight 504.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Also Known As: BAS 01810179, 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}acetohydrazide, (E)-2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide, 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(4-dimethylaminophenyl)methylideneamino]acetamide
| Molecular Formula | C26H25ClN6OS |
|---|---|
| Molecular Weight | 504.15 g/mol |
| LogP | 5.20452 |
| Topological Polar Surface Area | 75.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 504.1499 |
| Heavy Atoms | 35 |
| Complexity | 1315.7216 |
Chemical Identifiers
| CAS Number | 315231-46-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)Cl |
Product Overview
BAS 01810179 (CAS 315231-46-0), with molecular formula C26H25ClN6OS and molecular weight 504.15 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide.
Chemical Property Profile of BAS 01810179
Property Insights of BAS 01810179
The XLogP value of 5.20452 indicates that BAS 01810179 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.41 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01810179. Following Lipinski's Rule of Five, BAS 01810179 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01810179?
The CAS number of BAS 01810179 is 315231-46-0.
What is the molecular formula of BAS 01810179?
The molecular formula of BAS 01810179 is C26H25ClN6OS.
What is the molecular weight of BAS 01810179?
The molecular weight of BAS 01810179 is 504.15 g/mol.
Where can I buy BAS 01810179?
You can request a quote for BAS 01810179 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01810179?
Yes, KEHONG BIO provides custom synthesis services for BAS 01810179 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.