2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one
TL;DR: 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one (CAS 223704-94-7) is a chemical compound with molecular formula C16H13IN2OS and molecular weight 407.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one
Also Known As: 2-ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one, 2-Ethylsulfanyl-6-iodo-3-phenyl-3H-quinazolin-4-one, BAS 00603933, 2-(ethylthio)-6-iodo-3-phenylquinazolin-4(3H)-one, 2-(Ethylsulfanyl)-6-iodo-3-phenyl-4(3H)-quinazolinone
| Molecular Formula | C16H13IN2OS |
|---|---|
| Molecular Weight | 407.98 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.97934 |
| Heavy Atoms | 21 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 223704-94-7 |
|---|---|
| SMILES | CCSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3 |
| InChIKey | DDIANGUFTFYYAL-UHFFFAOYSA-N |
Product Overview
2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one (CAS 223704-94-7), with molecular formula C16H13IN2OS and molecular weight 407.98 g/mol. IUPAC: 2-ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one.
Chemical Property Profile of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one
Property Insights of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one
The XLogP value of 4.4 indicates that 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.0 Ų, 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one?
The CAS number of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one is 223704-94-7.
What is the molecular formula of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one?
The molecular formula of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one is C16H13IN2OS.
What is the molecular weight of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one?
The molecular weight of 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one is 407.98 g/mol.
Where can I buy 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one?
You can request a quote for 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylsulfanyl-6-iodo-3-phenylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.