![3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one structure](/static/products/467/467433-77-8.png)
3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one
TL;DR: 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one (CAS 467433-77-8) is a chemical compound with molecular formula C23H16ClIN2O2S and molecular weight 545.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-iodoquinazolin-4-one
Also Known As: 3-benzyl-2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-iodoquinazolin-4-one, 3-benzyl-2-((2-(4-chlorophenyl)-2-oxoethyl)thio)-6-iodoquinazolin-4(3H)-one, 3-benzyl-2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-6-iodo-quinazolin-4-one, 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one
| Molecular Formula | C23H16ClIN2O2S |
|---|---|
| Molecular Weight | 545.97 g/mol |
| LogP | 5.6778 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 545.96655 |
| Heavy Atoms | 30 |
| Complexity | 1274.3739 |
Chemical Identifiers
| CAS Number | 467433-77-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=CC=C(C=C4)Cl |
Product Overview
3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one (CAS 467433-77-8), with molecular formula C23H16ClIN2O2S and molecular weight 545.97 g/mol. IUPAC: 3-benzyl-2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-iodoquinazolin-4-one.
Chemical Property Profile of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one
Property Insights of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one
The XLogP value of 5.6778 indicates that 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one 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 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one?
The CAS number of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one is 467433-77-8.
What is the molecular formula of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one?
The molecular formula of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one is C23H16ClIN2O2S.
What is the molecular weight of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one?
The molecular weight of 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one is 545.97 g/mol.
Where can I buy 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one?
You can request a quote for 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-iodoquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.