(1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane
TL;DR: (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane (CAS 397880-23-8) is a chemical compound with molecular formula C18H23N3 and molecular weight 281.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decane
Also Known As: (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane, (5s,7s)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decane
| Molecular Formula | C18H23N3 |
|---|---|
| Molecular Weight | 281.19 g/mol |
| LogP | 3.214 |
| Topological Polar Surface Area | 22.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.1892 |
| Heavy Atoms | 21 |
| Complexity | 680.07666 |
Chemical Identifiers
| CAS Number | 397880-23-8 |
|---|---|
| SMILES | CC12CC3(CN(C1)C(N(C2)C3)C4=CNC5=CC=CC=C54)C |
Product Overview
(1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane (CAS 397880-23-8), with molecular formula C18H23N3 and molecular weight 281.19 g/mol. IUPAC: 2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decane.
Chemical Property Profile of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane
Property Insights of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane
The XLogP value of 3.214 indicates that (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.27 Ų, (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane has 1 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 (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane?
The CAS number of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane is 397880-23-8.
What is the molecular formula of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane?
The molecular formula of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane is C18H23N3.
What is the molecular weight of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane?
The molecular weight of (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane is 281.19 g/mol.
Where can I buy (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane?
You can request a quote for (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane?
Yes, KEHONG BIO provides custom synthesis services for (1r,3r,5r,7r)-2-(1H-indol-3-yl)-5,7-dimethyl-1,3-diazaadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.