RefChem:284176
TL;DR: RefChem:284176 (CAS 81262-75-1) is a chemical compound with molecular formula C27H26N4O2S and molecular weight 470.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 3-phenyl-2-((((4-(o-tolyl)-1-piperazinyl)carbonyl)methyl)thio)-, 3-Phenyl-2-((((4-(o-tolyl)-1-piperazinyl)carbonyl)methyl)thio)-4(3H)-quinazolinone, 2-[[[[4-(2-Methylphenyl)piperazin-1-yl]carbonyl]methyl]thio]-3-phenylquinazolin-4(3H)-one, 2-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one, 2-({2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-3-phenyl-3,4-dihydroquinazolin-4-one
| Molecular Formula | C27H26N4O2S |
|---|---|
| Molecular Weight | 470.18 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.17764 |
| Heavy Atoms | 34 |
| Complexity | 760.0 |
Chemical Identifiers
| CAS Number | 81262-75-1 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5 |
| InChIKey | KABQJDIJZOXOPM-UHFFFAOYSA-N |
Product Overview
RefChem:284176 (CAS 81262-75-1), with molecular formula C27H26N4O2S and molecular weight 470.18 g/mol. IUPAC: 2-[2-[4-(2-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one.
Chemical Property Profile of RefChem:284176
Property Insights of RefChem:284176
The XLogP value of 4.9 indicates that RefChem:284176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284176. Following Lipinski's Rule of Five, RefChem:284176 has 0 hydrogen bond donor(s) and 5 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 RefChem:284176?
The CAS number of RefChem:284176 is 81262-75-1.
What is the molecular formula of RefChem:284176?
The molecular formula of RefChem:284176 is C27H26N4O2S.
What is the molecular weight of RefChem:284176?
The molecular weight of RefChem:284176 is 470.18 g/mol.
Where can I buy RefChem:284176?
You can request a quote for RefChem:284176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:284176?
Yes, KEHONG BIO provides custom synthesis services for RefChem:284176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.