8L-322S
TL;DR: 8L-322S (CAS 339099-23-9) is a chemical compound with molecular formula C21H19Cl3N2O4S and molecular weight 500.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[7-chloro-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate
Also Known As: 8L-322S, ethyl 2-{[7-chloro-3-(2,4-dichloro-5-isopropoxyphenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetate, ethyl 2-[7-chloro-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate, ethyl 2-({7-chloro-3-[2,4-dichloro-5-(propan-2-yloxy)phenyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate, Ethyl 2-[7-chloro-3-(2,4-dichloro-5-propan-2-yloxy-phenyl)-4-oxo-quinazolin-2-yl]sulfanylacetate
| Molecular Formula | C21H19Cl3N2O4S |
|---|---|
| Molecular Weight | 500.01 g/mol |
| LogP | 5.7883 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 500.01312 |
| Heavy Atoms | 31 |
| Complexity | 1197.4388 |
Chemical Identifiers
| CAS Number | 339099-23-9 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC(=C(C=C3Cl)Cl)OC(C)C |
Product Overview
8L-322S (CAS 339099-23-9), with molecular formula C21H19Cl3N2O4S and molecular weight 500.01 g/mol. IUPAC: ethyl 2-[7-chloro-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate.
Chemical Property Profile of 8L-322S
Property Insights of 8L-322S
The XLogP value of 5.7883 indicates that 8L-322S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 8L-322S. Following Lipinski's Rule of Five, 8L-322S 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 8L-322S?
The CAS number of 8L-322S is 339099-23-9.
What is the molecular formula of 8L-322S?
The molecular formula of 8L-322S is C21H19Cl3N2O4S.
What is the molecular weight of 8L-322S?
The molecular weight of 8L-322S is 500.01 g/mol.
Where can I buy 8L-322S?
You can request a quote for 8L-322S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8L-322S?
Yes, KEHONG BIO provides custom synthesis services for 8L-322S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.