4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]
TL;DR: 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] (CAS 372154-57-9) is a chemical compound with molecular formula C23H22N2S and molecular weight 358.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanyl-2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]
Also Known As: AE-848/31946026, 4-(methylthio)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane], 4-methylsulfanyl-2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane], 4-(methylsulfanyl)-2-phenyl-5,6-dihydrospiro(benzo[h]quinazoline-5,1'-cyclopentane), 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]
| Molecular Formula | C23H22N2S |
|---|---|
| Molecular Weight | 358.15 g/mol |
| LogP | 5.9004 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.15036 |
| Heavy Atoms | 26 |
| Complexity | 959.1968 |
Chemical Identifiers
| CAS Number | 372154-57-9 |
|---|---|
| SMILES | CSC1=NC(=NC2=C1C3(CCCC3)CC4=CC=CC=C42)C5=CC=CC=C5 |
Product Overview
4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] (CAS 372154-57-9), with molecular formula C23H22N2S and molecular weight 358.15 g/mol. IUPAC: 4-methylsulfanyl-2-phenylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane].
Chemical Property Profile of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]
Property Insights of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]
The XLogP value of 5.9004 indicates that 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] 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 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]?
The CAS number of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] is 372154-57-9.
What is the molecular formula of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]?
The molecular formula of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] is C23H22N2S.
What is the molecular weight of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]?
The molecular weight of 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] is 358.15 g/mol.
Where can I buy 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]?
You can request a quote for 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]?
Yes, KEHONG BIO provides custom synthesis services for 4-(methylsulfanyl)-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.