8M-321S
TL;DR: 8M-321S (CAS 478080-23-8) is a chemical compound with molecular formula C16H10ClF3N4OS2 and molecular weight 429.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanyl]-5-[1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazol-5-yl]-1,3,4-oxadiazole
Also Known As: 8M-321S, 5-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-oxadiazol-2-yl}-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole, 2-[(4-chlorophenyl)methylsulfanyl]-5-[1-methyl-3-(trifluoromethyl)thieno[2,3-c]pyrazol-5-yl]-1,3,4-oxadiazole, 2-{[(4-chlorophenyl)methyl]sulfanyl}-5-[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazol-5-yl]-1,3,4-oxadiazole
| Molecular Formula | C16H10ClF3N4OS2 |
|---|---|
| Molecular Weight | 429.99 g/mol |
| LogP | 5.6493 |
| Topological Polar Surface Area | 56.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.99365 |
| Heavy Atoms | 27 |
| Complexity | 1101.4644 |
Chemical Identifiers
| CAS Number | 478080-23-8 |
|---|---|
| SMILES | CN1C2=C(C=C(S2)C3=NN=C(O3)SCC4=CC=C(C=C4)Cl)C(=N1)C(F)(F)F |
Product Overview
8M-321S (CAS 478080-23-8), with molecular formula C16H10ClF3N4OS2 and molecular weight 429.99 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-5-[1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazol-5-yl]-1,3,4-oxadiazole.
Chemical Property Profile of 8M-321S
Property Insights of 8M-321S
The XLogP value of 5.6493 indicates that 8M-321S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.74 Ų, 8M-321S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8M-321S has 0 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 8M-321S?
The CAS number of 8M-321S is 478080-23-8.
What is the molecular formula of 8M-321S?
The molecular formula of 8M-321S is C16H10ClF3N4OS2.
What is the molecular weight of 8M-321S?
The molecular weight of 8M-321S is 429.99 g/mol.
Where can I buy 8M-321S?
You can request a quote for 8M-321S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8M-321S?
Yes, KEHONG BIO provides custom synthesis services for 8M-321S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.