BAS 01809490
TL;DR: BAS 01809490 (CAS 315217-70-0) is a chemical compound with molecular formula C24H17ClF3N5OS and molecular weight 515.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]acetamide
Also Known As: BAS 01809490, 2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide, (E)-2-((5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(4-(trifluoromethyl)benzylidene)acetohydrazide, 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]acetamide, 2-{[5-(4-CHLOROPHENYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-N'-[(E)-[4-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE]ACETOHYDRAZIDE
| Molecular Formula | C24H17ClF3N5OS |
|---|---|
| Molecular Weight | 515.08 g/mol |
| LogP | 5.8489 |
| Topological Polar Surface Area | 72.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 515.07947 |
| Heavy Atoms | 35 |
| Complexity | 1324.2843 |
Chemical Identifiers
| CAS Number | 315217-70-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C3=CC=C(C=C3)C(F)(F)F)C4=CC=C(C=C4)Cl |
Product Overview
BAS 01809490 (CAS 315217-70-0), with molecular formula C24H17ClF3N5OS and molecular weight 515.08 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]acetamide.
Chemical Property Profile of BAS 01809490
Property Insights of BAS 01809490
The XLogP value of 5.8489 indicates that BAS 01809490 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.17 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01809490. Following Lipinski's Rule of Five, BAS 01809490 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01809490?
The CAS number of BAS 01809490 is 315217-70-0.
What is the molecular formula of BAS 01809490?
The molecular formula of BAS 01809490 is C24H17ClF3N5OS.
What is the molecular weight of BAS 01809490?
The molecular weight of BAS 01809490 is 515.08 g/mol.
Where can I buy BAS 01809490?
You can request a quote for BAS 01809490 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01809490?
Yes, KEHONG BIO provides custom synthesis services for BAS 01809490 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.