(1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol
TL;DR: (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol (CAS 897823-22-2) is a chemical compound with molecular formula C21H32N2O2 and molecular weight 344.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-diethyl-2-(4-propan-2-yloxyphenyl)-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol
Also Known As: (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol, 5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol, (5s,7s)-5,7-diethyl-2-[4-(propan-2-yloxy)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
| Molecular Formula | C21H32N2O2 |
|---|---|
| Molecular Weight | 344.25 g/mol |
| LogP | 3.2709 |
| Topological Polar Surface Area | 35.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.24637 |
| Heavy Atoms | 25 |
| Complexity | 587.28815 |
Chemical Identifiers
| CAS Number | 897823-22-2 |
|---|---|
| SMILES | CCC12CN3CC(C1O)(CN(C2)C3C4=CC=C(C=C4)OC(C)C)CC |
Product Overview
(1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol (CAS 897823-22-2), with molecular formula C21H32N2O2 and molecular weight 344.25 g/mol. IUPAC: 5,7-diethyl-2-(4-propan-2-yloxyphenyl)-1,3-diazatricyclo[3.3.1.13,7]decan-6-ol.
Chemical Property Profile of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol
Property Insights of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol
The XLogP value of 3.2709 indicates that (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.94 Ų, (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol has 1 hydrogen bond donor(s) and 4 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 (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol?
The CAS number of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol is 897823-22-2.
What is the molecular formula of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol?
The molecular formula of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol is C21H32N2O2.
What is the molecular weight of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol?
The molecular weight of (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol is 344.25 g/mol.
Where can I buy (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol?
You can request a quote for (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol?
Yes, KEHONG BIO provides custom synthesis services for (1r,5R,7S)-5,7-diethyl-2-(4-isopropoxyphenyl)-1,3-diazaadamantan-6-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.