6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone
TL;DR: 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone (CAS 664993-07-1) is a chemical compound with molecular formula C18H17IN2OS and molecular weight 436.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-iodo-3-(3-methylphenyl)-2-propan-2-ylsulfanylquinazolin-4-one
Also Known As: 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone, AL-281/41935167, 6-iodo-3-(3-methylphenyl)-2-propan-2-ylsulfanylquinazolin-4-one
| Molecular Formula | C18H17IN2OS |
|---|---|
| Molecular Weight | 436.01 g/mol |
| LogP | 4.79922 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.01062 |
| Heavy Atoms | 23 |
| Complexity | 933.9432 |
Chemical Identifiers
| CAS Number | 664993-07-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SC(C)C |
Product Overview
6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone (CAS 664993-07-1), with molecular formula C18H17IN2OS and molecular weight 436.01 g/mol. IUPAC: 6-iodo-3-(3-methylphenyl)-2-propan-2-ylsulfanylquinazolin-4-one.
Chemical Property Profile of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone
Property Insights of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone
The XLogP value of 4.79922 indicates that 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone 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 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone?
The CAS number of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone is 664993-07-1.
What is the molecular formula of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone?
The molecular formula of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone is C18H17IN2OS.
What is the molecular weight of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone?
The molecular weight of 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone is 436.01 g/mol.
Where can I buy 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone?
You can request a quote for 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 6-iodo-2-(isopropylsulfanyl)-3-(3-methylphenyl)-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.