C28H25ClN6OS
TL;DR: C28H25ClN6OS (CAS 304449-65-8) is a chemical compound with molecular formula C28H25ClN6OS and molecular weight 528.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]sulfanyl-N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide
Also Known As: (E)-2-((1-(4-chlorobenzyl)-1H-benzo[d]imidazol-2-yl)thio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide, 2-{[1-(4-chlorobenzyl)-1H-benzimidazol-2-yl]sulfanyl}-N'-[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
| Molecular Formula | C28H25ClN6OS |
|---|---|
| Molecular Weight | 528.15 g/mol |
| LogP | 5.78294 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 528.1499 |
| Heavy Atoms | 37 |
| Complexity | 1574.0907 |
Chemical Identifiers
| CAS Number | 304449-65-8 |
|---|---|
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N/NC(=O)CSC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)Cl |
Product Overview
C28H25ClN6OS (CAS 304449-65-8), with molecular formula C28H25ClN6OS and molecular weight 528.15 g/mol. IUPAC: 2-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]sulfanyl-N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide.
Chemical Property Profile of C28H25ClN6OS
Property Insights of C28H25ClN6OS
The XLogP value of 5.78294 indicates that C28H25ClN6OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C28H25ClN6OS. Following Lipinski's Rule of Five, C28H25ClN6OS 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 C28H25ClN6OS?
The CAS number of C28H25ClN6OS is 304449-65-8.
What is the molecular formula of C28H25ClN6OS?
The molecular formula of C28H25ClN6OS is C28H25ClN6OS.
What is the molecular weight of C28H25ClN6OS?
The molecular weight of C28H25ClN6OS is 528.15 g/mol.
Where can I buy C28H25ClN6OS?
You can request a quote for C28H25ClN6OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C28H25ClN6OS?
Yes, KEHONG BIO provides custom synthesis services for C28H25ClN6OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.