BAS 01810216
TL;DR: BAS 01810216 (CAS 315231-77-7) is a chemical compound with molecular formula C25H19ClN6O2S and molecular weight 502.10 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-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
Also Known As: BAS 01810216, 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide, (Z)-2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(2-oxoindolin-3-ylidene)acetohydrazide, 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N'-(2-oxoindol-3-yl)acetohydrazide, 2-[5-(4-chlorophenyl)-4-(4-methylphenyl)(1,2,4-triazol-3-ylthio)]-N-[(2-oxo(1H -benzo[d]azolin-3-ylidene))azamethyl]acetamide
| Molecular Formula | C25H19ClN6O2S |
|---|---|
| Molecular Weight | 502.10 g/mol |
| LogP | 6.48562 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 502.09787 |
| Heavy Atoms | 35 |
| Complexity | 1541.0436 |
Chemical Identifiers
| CAS Number | 315231-77-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N=NC3=C(NC4=CC=CC=C43)O)C5=CC=C(C=C5)Cl |
Product Overview
BAS 01810216 (CAS 315231-77-7), with molecular formula C25H19ClN6O2S and molecular weight 502.10 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide.
Chemical Property Profile of BAS 01810216
Property Insights of BAS 01810216
The XLogP value of 6.48562 indicates that BAS 01810216 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.52 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01810216. Following Lipinski's Rule of Five, BAS 01810216 has 2 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 01810216?
The CAS number of BAS 01810216 is 315231-77-7.
What is the molecular formula of BAS 01810216?
The molecular formula of BAS 01810216 is C25H19ClN6O2S.
What is the molecular weight of BAS 01810216?
The molecular weight of BAS 01810216 is 502.10 g/mol.
Where can I buy BAS 01810216?
You can request a quote for BAS 01810216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01810216?
Yes, KEHONG BIO provides custom synthesis services for BAS 01810216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.