(1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane
TL;DR: (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane (CAS 889809-05-6) is a chemical compound with molecular formula C19H28N2 and molecular weight 284.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dimethyl-2-(4-propan-2-ylphenyl)-1,3-diazatricyclo[3.3.1.13,7]decane
Also Known As: (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane, 2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decane, 5,7-dimethyl-2-[4-(propan-2-yl)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decane
| Molecular Formula | C19H28N2 |
|---|---|
| Molecular Weight | 284.23 g/mol |
| LogP | 3.8561 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.22525 |
| Heavy Atoms | 21 |
| Complexity | 509.1897 |
Chemical Identifiers
| CAS Number | 889809-05-6 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2N3CC4(CC(C3)(CN2C4)C)C |
Product Overview
(1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane (CAS 889809-05-6), with molecular formula C19H28N2 and molecular weight 284.23 g/mol. IUPAC: 5,7-dimethyl-2-(4-propan-2-ylphenyl)-1,3-diazatricyclo[3.3.1.13,7]decane.
Chemical Property Profile of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane
Property Insights of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane
The XLogP value of 3.8561 indicates that (1r,5R,7S)-2-(4-isopropylphenyl)-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 6.48 Ų, (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane has 0 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,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane?
The CAS number of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane is 889809-05-6.
What is the molecular formula of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane?
The molecular formula of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane is C19H28N2.
What is the molecular weight of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane?
The molecular weight of (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane is 284.23 g/mol.
Where can I buy (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane?
You can request a quote for (1r,5R,7S)-2-(4-isopropylphenyl)-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,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane?
Yes, KEHONG BIO provides custom synthesis services for (1r,5R,7S)-2-(4-isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.