BAS 01810239
TL;DR: BAS 01810239 (CAS 303105-35-3) is a chemical compound with molecular formula C25H20ClN5O3S and molecular weight 505.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-[[2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid
Also Known As: BAS 01810239, (E)-4-((2-(2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)benzoic acid, 4-((1E)-2-{2-[5-(4-chlorophenyl)-4-(4-methylphenyl)(1,2,4-triazol-3-ylthio)]ac etylamino}-2-azavinyl)benzoic acid, 4-[(E)-[(2-{[5-(4-CHLOROPHENYL)-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDO)IMINO]METHYL]BENZOIC ACID, 4-[(E)-[[2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid
| Molecular Formula | C25H20ClN5O3S |
|---|---|
| Molecular Weight | 505.10 g/mol |
| LogP | 4.83672 |
| Topological Polar Surface Area | 109.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.09753 |
| Heavy Atoms | 35 |
| Complexity | 1367.995 |
Chemical Identifiers
| CAS Number | 303105-35-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C/C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)Cl |
Product Overview
BAS 01810239 (CAS 303105-35-3), with molecular formula C25H20ClN5O3S and molecular weight 505.10 g/mol. IUPAC: 4-[(E)-[[2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]benzoic acid.
Chemical Property Profile of BAS 01810239
Property Insights of BAS 01810239
The XLogP value of 4.83672 indicates that BAS 01810239 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.47 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01810239. Following Lipinski's Rule of Five, BAS 01810239 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 01810239?
The CAS number of BAS 01810239 is 303105-35-3.
What is the molecular formula of BAS 01810239?
The molecular formula of BAS 01810239 is C25H20ClN5O3S.
What is the molecular weight of BAS 01810239?
The molecular weight of BAS 01810239 is 505.10 g/mol.
Where can I buy BAS 01810239?
You can request a quote for BAS 01810239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01810239?
Yes, KEHONG BIO provides custom synthesis services for BAS 01810239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.