F1174-2980
TL;DR: F1174-2980 (CAS 379236-07-4) is a chemical compound with molecular formula C28H21ClF3N3OS2 and molecular weight 571.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone
Also Known As: F1174-2980, 1-{1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-({2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl}sulfanyl)ethan-1-one, 1-(1-(4-chloro-3-(trifluoromethyl)phenyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-((2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)thio)ethanone, 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone
| Molecular Formula | C28H21ClF3N3OS2 |
|---|---|
| Molecular Weight | 571.08 g/mol |
| LogP | 8.72146 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 571.07666 |
| Heavy Atoms | 38 |
| Complexity | 1676.7406 |
Chemical Identifiers
| CAS Number | 379236-07-4 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC(=C(C=C2)Cl)C(F)(F)F)C)C(=O)CSC3=NC(=NC4=C3C=C(S4)C5=CC=CC=C5)C |
Product Overview
F1174-2980 (CAS 379236-07-4), with molecular formula C28H21ClF3N3OS2 and molecular weight 571.08 g/mol. IUPAC: 1-[1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone.
Chemical Property Profile of F1174-2980
Property Insights of F1174-2980
The XLogP value of 8.72146 indicates that F1174-2980 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.78 Ų, F1174-2980 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1174-2980 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1174-2980?
The CAS number of F1174-2980 is 379236-07-4.
What is the molecular formula of F1174-2980?
The molecular formula of F1174-2980 is C28H21ClF3N3OS2.
What is the molecular weight of F1174-2980?
The molecular weight of F1174-2980 is 571.08 g/mol.
Where can I buy F1174-2980?
You can request a quote for F1174-2980 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1174-2980?
Yes, KEHONG BIO provides custom synthesis services for F1174-2980 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.