7F-049
TL;DR: 7F-049 (CAS 339009-60-8) is a chemical compound with molecular formula C18H14F6N8S and molecular weight 488.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[[4-methyl-5-[2-(1,2,4-triazol-1-yl)propan-2-yl]-1,2,4-triazol-3-yl]sulfanyl]-2,4-bis(trifluoromethyl)-1,8-naphthyridine
Also Known As: 7F-049, 7-[[4-methyl-5-[2-(1,2,4-triazol-1-yl)propan-2-yl]-1,2,4-triazol-3-yl]sulfanyl]-2,4-bis(trifluoromethyl)-1,8-naphthyridine, 7-({4-methyl-5-[2-(1H-1,2,4-triazol-1-yl)propan-2-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-2,4-bis(trifluoromethyl)-1,8-naphthyridine, 5,7-bis(trifluoromethyl)[1,8]naphthyridin-2-yl 4-methyl-5-[1-methyl-1-(1H-1,2,4-triazol-1-yl)ethyl]-4H-1,2,4-triazol-3-yl sulfide, 1,8-NAPHTHYRIDINE, 7-[[4-METHYL-5-[1-METHYL-1-(1H-1,2,4-TRIAZOL-1-YL)ETHYL]-4H-1,2,4-TRIAZOL-3-YL]THIO]-2,4-BIS(TRIFLUOROMETHYL)-
| Molecular Formula | C18H14F6N8S |
|---|---|
| Molecular Weight | 488.10 g/mol |
| LogP | 4.322 |
| Topological Polar Surface Area | 87.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.09662 |
| Heavy Atoms | 33 |
| Complexity | 1310.2065 |
Chemical Identifiers
| CAS Number | 339009-60-8 |
|---|---|
| SMILES | CC(C)(C1=NN=C(N1C)SC2=NC3=C(C=C2)C(=CC(=N3)C(F)(F)F)C(F)(F)F)N4C=NC=N4 |
Product Overview
7F-049 (CAS 339009-60-8), with molecular formula C18H14F6N8S and molecular weight 488.10 g/mol. IUPAC: 7-[[4-methyl-5-[2-(1,2,4-triazol-1-yl)propan-2-yl]-1,2,4-triazol-3-yl]sulfanyl]-2,4-bis(trifluoromethyl)-1,8-naphthyridine.
Chemical Property Profile of 7F-049
Property Insights of 7F-049
The XLogP value of 4.322 indicates that 7F-049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7F-049. Following Lipinski's Rule of Five, 7F-049 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7F-049?
The CAS number of 7F-049 is 339009-60-8.
What is the molecular formula of 7F-049?
The molecular formula of 7F-049 is C18H14F6N8S.
What is the molecular weight of 7F-049?
The molecular weight of 7F-049 is 488.10 g/mol.
Where can I buy 7F-049?
You can request a quote for 7F-049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7F-049?
Yes, KEHONG BIO provides custom synthesis services for 7F-049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.