3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one
TL;DR: 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one (CAS 708222-62-2) is a chemical compound with molecular formula C15H19IN2OS and molecular weight 402.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-6-iodo-2-pentylsulfanylquinazolin-4-one
Also Known As: 3-ethyl-6-iodo-2-pentylsulfanylquinazolin-4-one, 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one, 3-ethyl-6-iodo-2-(pentylthio)-4(3H)-quinazolinone, 3-ethyl-6-iodo-2-(pentylthio)quinazolin-4(3H)-one
| Molecular Formula | C15H19IN2OS |
|---|---|
| Molecular Weight | 402.03 g/mol |
| LogP | 4.3033 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.02628 |
| Heavy Atoms | 20 |
| Complexity | 654.09894 |
Chemical Identifiers
| CAS Number | 708222-62-2 |
|---|---|
| SMILES | CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC |
Product Overview
3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one (CAS 708222-62-2), with molecular formula C15H19IN2OS and molecular weight 402.03 g/mol. IUPAC: 3-ethyl-6-iodo-2-pentylsulfanylquinazolin-4-one.
Chemical Property Profile of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one
Property Insights of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one
The XLogP value of 4.3033 indicates that 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-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 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one?
The CAS number of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one is 708222-62-2.
What is the molecular formula of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one?
The molecular formula of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one is C15H19IN2OS.
What is the molecular weight of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one?
The molecular weight of 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one is 402.03 g/mol.
Where can I buy 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one?
You can request a quote for 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-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-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-ethyl-6-iodo-2-(pentylsulfanyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.