BAS 01809418
TL;DR: BAS 01809418 (CAS 315216-93-4) is a chemical compound with molecular formula C27H27N5O4S and molecular weight 517.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(3-methoxyphenyl)ethylideneamino]acetamide
Also Known As: BAS 01809418, 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(3-methoxyphenyl)ethylidene]acetohydrazide, (E)-2-((5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(3-methoxyphenyl)ethylidene)acetohydrazide, N-[(1E)-2-(3-methoxyphenyl)-1-azaprop-1-enyl]-2-[5-(3,4-dimethoxyphenyl)-4-phe nyl(1,2,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C27H27N5O4S |
|---|---|
| Molecular Weight | 517.18 g/mol |
| LogP | 4.5926 |
| Topological Polar Surface Area | 99.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 517.1784 |
| Heavy Atoms | 37 |
| Complexity | 1405.1892 |
Chemical Identifiers
| CAS Number | 315216-93-4 |
|---|---|
| SMILES | C/C(=N\NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC)/C4=CC(=CC=C4)OC |
Product Overview
BAS 01809418 (CAS 315216-93-4), with molecular formula C27H27N5O4S and molecular weight 517.18 g/mol. IUPAC: 2-[[5-(3,4-dimethoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(3-methoxyphenyl)ethylideneamino]acetamide.
Chemical Property Profile of BAS 01809418
Property Insights of BAS 01809418
The XLogP value of 4.5926 indicates that BAS 01809418 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01809418. Following Lipinski's Rule of Five, BAS 01809418 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01809418?
The CAS number of BAS 01809418 is 315216-93-4.
What is the molecular formula of BAS 01809418?
The molecular formula of BAS 01809418 is C27H27N5O4S.
What is the molecular weight of BAS 01809418?
The molecular weight of BAS 01809418 is 517.18 g/mol.
Where can I buy BAS 01809418?
You can request a quote for BAS 01809418 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01809418?
Yes, KEHONG BIO provides custom synthesis services for BAS 01809418 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.