7N-377S
TL;DR: 7N-377S (CAS 339019-04-4) is a chemical compound with molecular formula C22H18ClF3N2OS and molecular weight 450.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanyl]-4-[3-(trifluoromethyl)phenoxy]-5,6,7,8-tetrahydroquinazoline
Also Known As: 7N-377S, 2-[(4-chlorobenzyl)sulfanyl]-5,6,7,8-tetrahydro-4-quinazolinyl 3-(trifluoromethyl)phenyl ether, 2-[(4-chlorophenyl)methylsulfanyl]-4-[3-(trifluoromethyl)phenoxy]-5,6,7,8-tetrahydroquinazoline, 2-{[(4-chlorophenyl)methyl]sulfanyl}-4-[3-(trifluoromethyl)phenoxy]-5,6,7,8-tetrahydroquinazoline
| Molecular Formula | C22H18ClF3N2OS |
|---|---|
| Molecular Weight | 450.08 g/mol |
| LogP | 7.1122 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.07803 |
| Heavy Atoms | 30 |
| Complexity | 1041.5428 |
Chemical Identifiers
| CAS Number | 339019-04-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=NC(=N2)SCC3=CC=C(C=C3)Cl)OC4=CC=CC(=C4)C(F)(F)F |
Product Overview
7N-377S (CAS 339019-04-4), with molecular formula C22H18ClF3N2OS and molecular weight 450.08 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-4-[3-(trifluoromethyl)phenoxy]-5,6,7,8-tetrahydroquinazoline.
Chemical Property Profile of 7N-377S
Property Insights of 7N-377S
The XLogP value of 7.1122 indicates that 7N-377S 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-377S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7N-377S 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-377S?
The CAS number of 7N-377S is 339019-04-4.
What is the molecular formula of 7N-377S?
The molecular formula of 7N-377S is C22H18ClF3N2OS.
What is the molecular weight of 7N-377S?
The molecular weight of 7N-377S is 450.08 g/mol.
Where can I buy 7N-377S?
You can request a quote for 7N-377S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7N-377S?
Yes, KEHONG BIO provides custom synthesis services for 7N-377S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.