3M-344S
TL;DR: 3M-344S (CAS 478031-75-3) is a chemical compound with molecular formula C14H10BrF3N2S2 and molecular weight 405.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-bromophenyl)sulfanylmethyl]-1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazole
Also Known As: 3M-344S, 5-{[(4-bromophenyl)sulfanyl]methyl}-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole, 5-[(4-bromophenyl)sulfanylmethyl]-1-methyl-3-(trifluoromethyl)thieno[2,3-c]pyrazole
| Molecular Formula | C14H10BrF3N2S2 |
|---|---|
| Molecular Weight | 405.94 g/mol |
| LogP | 5.7084 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.94208 |
| Heavy Atoms | 22 |
| Complexity | 805.9576 |
Chemical Identifiers
| CAS Number | 478031-75-3 |
|---|---|
| SMILES | CN1C2=C(C=C(S2)CSC3=CC=C(C=C3)Br)C(=N1)C(F)(F)F |
Product Overview
3M-344S (CAS 478031-75-3), with molecular formula C14H10BrF3N2S2 and molecular weight 405.94 g/mol. IUPAC: 5-[(4-bromophenyl)sulfanylmethyl]-1-methyl-3-(trifluoromethyl)thieno[3,2-d]pyrazole.
Chemical Property Profile of 3M-344S
Property Insights of 3M-344S
The XLogP value of 5.7084 indicates that 3M-344S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 3M-344S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3M-344S 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 3M-344S?
The CAS number of 3M-344S is 478031-75-3.
What is the molecular formula of 3M-344S?
The molecular formula of 3M-344S is C14H10BrF3N2S2.
What is the molecular weight of 3M-344S?
The molecular weight of 3M-344S is 405.94 g/mol.
Where can I buy 3M-344S?
You can request a quote for 3M-344S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3M-344S?
Yes, KEHONG BIO provides custom synthesis services for 3M-344S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.