7K-301S
TL;DR: 7K-301S (CAS 318951-85-8) is a chemical compound with molecular formula C23H17Cl3N2S2 and molecular weight 489.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)sulfanyl-4-[(2,6-dichlorophenyl)sulfanylmethyl]-1-methyl-3-phenylpyrazole
Also Known As: 7K-301S, 5-[(4-chlorophenyl)sulfanyl]-4-{[(2,6-dichlorophenyl)sulfanyl]methyl}-1-methyl-3-phenyl-1H-pyrazole, 5-(4-chlorophenyl)sulfanyl-4-[(2,6-dichlorophenyl)sulfanylmethyl]-1-methyl-3-phenylpyrazole, 4-chlorophenyl 4-{[(2,6-dichlorophenyl)sulfanyl]methyl}-1-methyl-3-phenyl-1H-pyrazol-5-yl sulfide, 5-(4-chlorophenyl)sulfanyl-4-[(2,6-dichlorophenyl)sulfanylmethyl]-1-methyl-3-phenyl-pyrazole
| Molecular Formula | C23H17Cl3N2S2 |
|---|---|
| Molecular Weight | 489.99 g/mol |
| LogP | 8.4908 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 489.98987 |
| Heavy Atoms | 30 |
| Complexity | 1139.0442 |
Chemical Identifiers
| CAS Number | 318951-85-8 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C2=CC=CC=C2)CSC3=C(C=CC=C3Cl)Cl)SC4=CC=C(C=C4)Cl |
Product Overview
7K-301S (CAS 318951-85-8), with molecular formula C23H17Cl3N2S2 and molecular weight 489.99 g/mol. IUPAC: 5-(4-chlorophenyl)sulfanyl-4-[(2,6-dichlorophenyl)sulfanylmethyl]-1-methyl-3-phenylpyrazole.
Chemical Property Profile of 7K-301S
Property Insights of 7K-301S
The XLogP value of 8.4908 indicates that 7K-301S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 7K-301S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7K-301S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7K-301S?
The CAS number of 7K-301S is 318951-85-8.
What is the molecular formula of 7K-301S?
The molecular formula of 7K-301S is C23H17Cl3N2S2.
What is the molecular weight of 7K-301S?
The molecular weight of 7K-301S is 489.99 g/mol.
Where can I buy 7K-301S?
You can request a quote for 7K-301S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7K-301S?
Yes, KEHONG BIO provides custom synthesis services for 7K-301S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.