6K-502S
TL;DR: 6K-502S (CAS 338965-66-5) is a chemical compound with molecular formula C23H19ClN2O2S and molecular weight 422.09 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-methoxyphenyl)sulfanylmethyl]quinazolin-4-one
Also Known As: 6K-502S, 3-(4-chloro-2-methylphenyl)-2-{[(2-methoxyphenyl)sulfanyl]methyl}-4(3H)-quinazolinone, 3-(4-chloro-2-methylphenyl)-2-[(2-methoxyphenyl)sulfanylmethyl]quinazolin-4-one, 3-(4-chloro-2-methylphenyl)-2-{[(2-methoxyphenyl)sulfanyl]methyl}-3,4-dihydroquinazolin-4-one, 3-(4-chloro-2-methyl-phenyl)-2-[(2-methoxyphenyl)sulfanylmethyl]quinazolin-4-one
| Molecular Formula | C23H19ClN2O2S |
|---|---|
| Molecular Weight | 422.09 g/mol |
| LogP | 5.64842 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.08557 |
| Heavy Atoms | 29 |
| Complexity | 1253.3074 |
Chemical Identifiers
| CAS Number | 338965-66-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)N2C(=NC3=CC=CC=C3C2=O)CSC4=CC=CC=C4OC |
Product Overview
6K-502S (CAS 338965-66-5), with molecular formula C23H19ClN2O2S and molecular weight 422.09 g/mol. IUPAC: 3-(4-chloro-2-methylphenyl)-2-[(2-methoxyphenyl)sulfanylmethyl]quinazolin-4-one.
Chemical Property Profile of 6K-502S
Property Insights of 6K-502S
The XLogP value of 5.64842 indicates that 6K-502S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 6K-502S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6K-502S 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 6K-502S?
The CAS number of 6K-502S is 338965-66-5.
What is the molecular formula of 6K-502S?
The molecular formula of 6K-502S is C23H19ClN2O2S.
What is the molecular weight of 6K-502S?
The molecular weight of 6K-502S is 422.09 g/mol.
Where can I buy 6K-502S?
You can request a quote for 6K-502S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6K-502S?
Yes, KEHONG BIO provides custom synthesis services for 6K-502S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.