1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione
TL;DR: 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione (CAS 317844-86-3) is a chemical compound with molecular formula C13H23N3OS and molecular weight 269.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-8a-hydroxyspiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione
Also Known As: 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione, 1-amino-8a-hydroxyspiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione, 2-amino-3-thioxo-2,4-diazaspiro[bicyclo[4.4.0]decane-5,1'-cyclohexane]-1-ol
| Molecular Formula | C13H23N3OS |
|---|---|
| Molecular Weight | 269.16 g/mol |
| LogP | 1.6319 |
| Topological Polar Surface Area | 61.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.1562 |
| Heavy Atoms | 18 |
| Complexity | 356.1455 |
Chemical Identifiers
| CAS Number | 317844-86-3 |
|---|---|
| SMILES | C1CCC2(CC1)C3CCCCC3(N(C(=S)N2)N)O |
Product Overview
1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione (CAS 317844-86-3), with molecular formula C13H23N3OS and molecular weight 269.16 g/mol. IUPAC: 1-amino-8a-hydroxyspiro[3,4a,5,6,7,8-hexahydroquinazoline-4,1'-cyclohexane]-2-thione.
Chemical Property Profile of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione
Property Insights of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione
The XLogP value of 1.6319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione. The TPSA of 61.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione. Following Lipinski's Rule of Five, 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione has 3 hydrogen bond donor(s) and 3 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 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
The CAS number of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is 317844-86-3.
What is the molecular formula of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
The molecular formula of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is C13H23N3OS.
What is the molecular weight of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
The molecular weight of 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione is 269.16 g/mol.
Where can I buy 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
You can request a quote for 1'-amino-8a'-hydroxyhexahydro-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 1'-amino-8a'-hydroxyhexahydro-1'H-spiro[cyclohexane-1,4'-quinazoline]-2'(3'H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 1'-amino-8a'-hydroxyhexahydro-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.