7N-469S
TL;DR: 7N-469S (CAS 339019-34-0) is a chemical compound with molecular formula C21H17ClF2N2OS and molecular weight 418.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-chlorophenyl)methylsulfanyl]-4-(2,4-difluorophenoxy)-5,6,7,8-tetrahydroquinazoline
Also Known As: 7N-469S, 2-[(2-chlorophenyl)methylsulfanyl]-4-(2,4-difluorophenoxy)-5,6,7,8-tetrahydroquinazoline, 2-[(2-chlorobenzyl)sulfanyl]-5,6,7,8-tetrahydro-4-quinazolinyl 2,4-difluorophenyl ether, 2-{[(2-chlorophenyl)methyl]sulfanyl}-4-(2,4-difluorophenoxy)-5,6,7,8-tetrahydroquinazoline, 2-[[(2-Chlorophenyl)methyl]thio]-4-(2,4-difluorophenoxy)-5,6,7,8-tetrahydroquinazoline
| Molecular Formula | C21H17ClF2N2OS |
|---|---|
| Molecular Weight | 418.07 g/mol |
| LogP | 6.3716 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0718 |
| Heavy Atoms | 28 |
| Complexity | 1015.6909 |
Chemical Identifiers
| CAS Number | 339019-34-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=NC(=N2)SCC3=CC=CC=C3Cl)OC4=C(C=C(C=C4)F)F |
Product Overview
7N-469S (CAS 339019-34-0), with molecular formula C21H17ClF2N2OS and molecular weight 418.07 g/mol. IUPAC: 2-[(2-chlorophenyl)methylsulfanyl]-4-(2,4-difluorophenoxy)-5,6,7,8-tetrahydroquinazoline.
Chemical Property Profile of 7N-469S
Property Insights of 7N-469S
The XLogP value of 6.3716 indicates that 7N-469S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.01 Ų, 7N-469S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7N-469S has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7N-469S?
The CAS number of 7N-469S is 339019-34-0.
What is the molecular formula of 7N-469S?
The molecular formula of 7N-469S is C21H17ClF2N2OS.
What is the molecular weight of 7N-469S?
The molecular weight of 7N-469S is 418.07 g/mol.
Where can I buy 7N-469S?
You can request a quote for 7N-469S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7N-469S?
Yes, KEHONG BIO provides custom synthesis services for 7N-469S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.