![2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one structure](/static/products/488/488794-29-2.png)
2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
TL;DR: 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one (CAS 488794-29-2) is a chemical compound with molecular formula C28H30N2O2S and molecular weight 458.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one, 2-((2-oxo-2-phenylethyl)thio)-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 2-[(2-oxo-2-phenylethyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
| Molecular Formula | C28H30N2O2S |
|---|---|
| Molecular Weight | 458.20 g/mol |
| LogP | 6.0533 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.2028 |
| Heavy Atoms | 33 |
| Complexity | 1226.3899 |
Chemical Identifiers
| CAS Number | 488794-29-2 |
|---|---|
| SMILES | CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CC=C5 |
Product Overview
2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one (CAS 488794-29-2), with molecular formula C28H30N2O2S and molecular weight 458.20 g/mol. IUPAC: 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Property Insights of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
The XLogP value of 6.0533 indicates that 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one 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 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one?
The CAS number of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one is 488794-29-2.
What is the molecular formula of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one?
The molecular formula of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one is C28H30N2O2S.
What is the molecular weight of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one?
The molecular weight of 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one is 458.20 g/mol.
Where can I buy 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one?
You can request a quote for 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-phenacylsulfanyl-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.