11B-107
TL;DR: 11B-107 (CAS 400074-72-8) is a chemical compound with molecular formula C14H17ClN2O2S3 and molecular weight 376.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[bis(ethylsulfanyl)methyl]-1-(4-chlorophenyl)sulfonylpyrazole
Also Known As: 11B-107, 5-[bis(ethylsulfanyl)methyl]-1-(4-chlorophenyl)sulfonylpyrazole, {1-[(4-chlorophenyl)sulfonyl]-1H-pyrazol-5-yl}(ethylsulfanyl)methyl ethyl sulfide, 5-[bis(ethylsulfanyl)methyl]-1-(4-chlorobenzenesulfonyl)-1H-pyrazole
| Molecular Formula | C14H17ClN2O2S3 |
|---|---|
| Molecular Weight | 376.01 g/mol |
| LogP | 4.2783 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.01407 |
| Heavy Atoms | 22 |
| Complexity | 707.9441 |
Chemical Identifiers
| CAS Number | 400074-72-8 |
|---|---|
| SMILES | CCSC(C1=CC=NN1S(=O)(=O)C2=CC=C(C=C2)Cl)SCC |
Product Overview
11B-107 (CAS 400074-72-8), with molecular formula C14H17ClN2O2S3 and molecular weight 376.01 g/mol. IUPAC: 5-[bis(ethylsulfanyl)methyl]-1-(4-chlorophenyl)sulfonylpyrazole.
Chemical Property Profile of 11B-107
Property Insights of 11B-107
The XLogP value of 4.2783 indicates that 11B-107 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 11B-107 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11B-107 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11B-107?
The CAS number of 11B-107 is 400074-72-8.
What is the molecular formula of 11B-107?
The molecular formula of 11B-107 is C14H17ClN2O2S3.
What is the molecular weight of 11B-107?
The molecular weight of 11B-107 is 376.01 g/mol.
Where can I buy 11B-107?
You can request a quote for 11B-107 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11B-107?
Yes, KEHONG BIO provides custom synthesis services for 11B-107 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.