RefChem:284160
TL;DR: RefChem:284160 (CAS 81262-77-3) is a chemical compound with molecular formula C28H28N4O3S and molecular weight 500.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-2-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 3-(p-methoxyphenyl)-2-((((4-(o-tolyl)-1-piperazinyl)carbonyl)methyl)thio)-, 3-(4-methoxyphenyl)-2-({2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-3,4-dihydroquinazolin-4-one, 3-(4-Methoxyphenyl)-2-({2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)quinazolin-4(3H)-one, 3-(4-Methoxyphenyl)-2-[[[[4-(2-methylphenyl)piperazin-1-yl]carbonyl]methyl]thio]quinazolin-4(3H)-one, 3-(4-methoxyphenyl)-2-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one
| Molecular Formula | C28H28N4O3S |
|---|---|
| Molecular Weight | 500.19 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 90.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 500.1882 |
| Heavy Atoms | 36 |
| Complexity | 807.0 |
Chemical Identifiers
| CAS Number | 81262-77-3 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)OC |
| InChIKey | YPXCEDSAQBDHGF-UHFFFAOYSA-N |
Product Overview
RefChem:284160 (CAS 81262-77-3), with molecular formula C28H28N4O3S and molecular weight 500.19 g/mol. IUPAC: 3-(4-methoxyphenyl)-2-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one.
Chemical Property Profile of RefChem:284160
Property Insights of RefChem:284160
The XLogP value of 4.8 indicates that RefChem:284160 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284160. Following Lipinski's Rule of Five, RefChem:284160 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:284160?
The CAS number of RefChem:284160 is 81262-77-3.
What is the molecular formula of RefChem:284160?
The molecular formula of RefChem:284160 is C28H28N4O3S.
What is the molecular weight of RefChem:284160?
The molecular weight of RefChem:284160 is 500.19 g/mol.
Where can I buy RefChem:284160?
You can request a quote for RefChem:284160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:284160?
Yes, KEHONG BIO provides custom synthesis services for RefChem:284160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.