![8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione structure](/static/products/7810/78102-48-4.webp)
8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione
TL;DR: 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione (CAS 78102-48-4) is a chemical compound with molecular formula C21H30N2OS and molecular weight 358.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8a-hydroxy-1-(2-phenylethyl)spiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione
Also Known As: 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione, 8a-hydroxy-1-phenethylspiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione, 8a'-hydroxy-1'-(2-phenylethyl)hexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione, 8a-hydroxy-1-(2-phenylethyl)spiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione
| Molecular Formula | C21H30N2OS |
|---|---|
| Molecular Weight | 358.21 g/mol |
| LogP | 4.0009 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.2079 |
| Heavy Atoms | 25 |
| Complexity | 613.5819 |
Chemical Identifiers
| CAS Number | 78102-48-4 |
|---|---|
| SMILES | C1CCC2(CC1)C3CCCCC3(N(C(=S)N2)CCC4=CC=CC=C4)O |
Product Overview
8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione (CAS 78102-48-4), with molecular formula C21H30N2OS and molecular weight 358.21 g/mol. IUPAC: 8a-hydroxy-1-(2-phenylethyl)spiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione.
Chemical Property Profile of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione
Property Insights of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione
The XLogP value of 4.0009 indicates that 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione has 2 hydrogen bond donor(s) and 2 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 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
The CAS number of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is 78102-48-4.
What is the molecular formula of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
The molecular formula of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is C21H30N2OS.
What is the molecular weight of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
The molecular weight of 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is 358.21 g/mol.
Where can I buy 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
You can request a quote for 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 8a'-hydroxy-1'-phenethylhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.