F1174-3189
TL;DR: F1174-3189 (CAS 670271-06-4) is a chemical compound with molecular formula C24H28N4O3S3 and molecular weight 516.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
Also Known As: F1174-3189, AF-399/40851180, 1-[4-[(4-Methylphenyl)sulfonyl]-1-piperazinyl]-2-[(5,6,7,8-tetrahydro-2-methyl[1]benzothieno[2,3-d]pyrimidin-4-yl)thio]ethanone, 2-({5-methyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-yl}sulfanyl)-1-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]ethan-1-one, 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
| Molecular Formula | C24H28N4O3S3 |
|---|---|
| Molecular Weight | 516.13 g/mol |
| LogP | 3.81214 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 516.1323 |
| Heavy Atoms | 34 |
| Complexity | 1327.7422 |
Chemical Identifiers
| CAS Number | 670271-06-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC(=NC4=C3C5=C(S4)CCCC5)C |
Product Overview
F1174-3189 (CAS 670271-06-4), with molecular formula C24H28N4O3S3 and molecular weight 516.13 g/mol. IUPAC: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone.
Chemical Property Profile of F1174-3189
Property Insights of F1174-3189
The XLogP value of 3.81214 indicates that F1174-3189 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for F1174-3189. Following Lipinski's Rule of Five, F1174-3189 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1174-3189?
The CAS number of F1174-3189 is 670271-06-4.
What is the molecular formula of F1174-3189?
The molecular formula of F1174-3189 is C24H28N4O3S3.
What is the molecular weight of F1174-3189?
The molecular weight of F1174-3189 is 516.13 g/mol.
Where can I buy F1174-3189?
You can request a quote for F1174-3189 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1174-3189?
Yes, KEHONG BIO provides custom synthesis services for F1174-3189 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.