6R-1307
TL;DR: 6R-1307 (CAS 439111-32-7) is a chemical compound with molecular formula C26H20F3N3OS2 and molecular weight 511.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,13-dimethyl-4-[(4-methylphenyl)methylsulfanyl]-6-[3-(trifluoromethyl)phenoxy]-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
Also Known As: 6R-1307, 7,9-dimethyl-2-[(4-methylbenzyl)sulfanyl]-4-[3-(trifluoromethyl)phenoxy]pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 11,13-dimethyl-4-[(4-methylphenyl)methylsulfanyl]-6-[3-(trifluoromethyl)phenoxy]-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene, 11,13-dimethyl-4-{[(4-methylphenyl)methyl]sulfanyl}-6-[3-(trifluoromethyl)phenoxy]-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene
| Molecular Formula | C26H20F3N3OS2 |
|---|---|
| Molecular Weight | 511.10 g/mol |
| LogP | 8.26816 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 511.09998 |
| Heavy Atoms | 35 |
| Complexity | 1546.3671 |
Chemical Identifiers
| CAS Number | 439111-32-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CSC2=NC3=C(C(=N2)OC4=CC=CC(=C4)C(F)(F)F)SC5=C3C(=CC(=N5)C)C |
Product Overview
6R-1307 (CAS 439111-32-7), with molecular formula C26H20F3N3OS2 and molecular weight 511.10 g/mol. IUPAC: 11,13-dimethyl-4-[(4-methylphenyl)methylsulfanyl]-6-[3-(trifluoromethyl)phenoxy]-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.
Chemical Property Profile of 6R-1307
Property Insights of 6R-1307
The XLogP value of 8.26816 indicates that 6R-1307 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 6R-1307 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6R-1307 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 6R-1307?
The CAS number of 6R-1307 is 439111-32-7.
What is the molecular formula of 6R-1307?
The molecular formula of 6R-1307 is C26H20F3N3OS2.
What is the molecular weight of 6R-1307?
The molecular weight of 6R-1307 is 511.10 g/mol.
Where can I buy 6R-1307?
You can request a quote for 6R-1307 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6R-1307?
Yes, KEHONG BIO provides custom synthesis services for 6R-1307 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.