4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol
TL;DR: 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol (CAS 897836-75-8) is a chemical compound with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5,7-diethyl-6-hydroxy-1,3-diazatricyclo[3.3.1.13,7]decan-2-yl)benzene-1,3-diol
Also Known As: 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol, 4-[(5s,7s)-5,7-diethyl-6-hydroxy-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl]benzene-1,3-diol
| Molecular Formula | C18H26N2O3 |
|---|---|
| Molecular Weight | 318.19 g/mol |
| LogP | 1.8949 |
| Topological Polar Surface Area | 67.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.19434 |
| Heavy Atoms | 23 |
| Complexity | 592.69275 |
Chemical Identifiers
| CAS Number | 897836-75-8 |
|---|---|
| SMILES | CCC12CN3CC(C1O)(CN(C2)C3C4=C(C=C(C=C4)O)O)CC |
Product Overview
4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol (CAS 897836-75-8), with molecular formula C18H26N2O3 and molecular weight 318.19 g/mol. IUPAC: 4-(5,7-diethyl-6-hydroxy-1,3-diazatricyclo[3.3.1.13,7]decan-2-yl)benzene-1,3-diol.
Chemical Property Profile of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol
Property Insights of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol
The XLogP value of 1.8949 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol. The TPSA of 67.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol. Following Lipinski's Rule of Five, 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol has 3 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 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
The CAS number of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol is 897836-75-8.
What is the molecular formula of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
The molecular formula of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol is C18H26N2O3.
What is the molecular weight of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
The molecular weight of 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol is 318.19 g/mol.
Where can I buy 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
You can request a quote for 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-((1r,5R,7S)-5,7-diethyl-6-hydroxy-1,3-diazaadamantan-2-yl)benzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.