5K-670S
TL;DR: 5K-670S (CAS 338959-62-9) is a chemical compound with molecular formula C22H15Cl3N2OS and molecular weight 460.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-2-methylphenyl)-2-[(2,6-dichlorophenyl)sulfanylmethyl]quinazolin-4-one
Also Known As: 5K-670S, 3-(4-chloro-2-methylphenyl)-2-{[(2,6-dichlorophenyl)sulfanyl]methyl}-4(3H)-quinazolinone, 3-(4-chloro-2-methylphenyl)-2-[(2,6-dichlorophenyl)sulfanylmethyl]quinazolin-4-one, 3-(4-chloro-2-methylphenyl)-2-{[(2,6-dichlorophenyl)sulfanyl]methyl}-3,4-dihydroquinazolin-4-one, 3-(4-chloro-2-methyl-phenyl)-2-[(2,6-dichlorophenyl)sulfanylmethyl]quinazolin-4-one
| Molecular Formula | C22H15Cl3N2OS |
|---|---|
| Molecular Weight | 460.00 g/mol |
| LogP | 6.94662 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.99707 |
| Heavy Atoms | 29 |
| Complexity | 1266.7773 |
Chemical Identifiers
| CAS Number | 338959-62-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)N2C(=NC3=CC=CC=C3C2=O)CSC4=C(C=CC=C4Cl)Cl |
Product Overview
5K-670S (CAS 338959-62-9), with molecular formula C22H15Cl3N2OS and molecular weight 460.00 g/mol. IUPAC: 3-(4-chloro-2-methylphenyl)-2-[(2,6-dichlorophenyl)sulfanylmethyl]quinazolin-4-one.
Chemical Property Profile of 5K-670S
Property Insights of 5K-670S
The XLogP value of 6.94662 indicates that 5K-670S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 5K-670S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5K-670S has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5K-670S?
The CAS number of 5K-670S is 338959-62-9.
What is the molecular formula of 5K-670S?
The molecular formula of 5K-670S is C22H15Cl3N2OS.
What is the molecular weight of 5K-670S?
The molecular weight of 5K-670S is 460.00 g/mol.
Where can I buy 5K-670S?
You can request a quote for 5K-670S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5K-670S?
Yes, KEHONG BIO provides custom synthesis services for 5K-670S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.