3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-
TL;DR: 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- (CAS 51808-79-8) is a chemical compound with molecular formula C22H24N2O and molecular weight 332.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-bis(3-methylphenyl)-1,3-diazatricyclo[3.3.1.13,7]decan-6-one
Also Known As: 1,5-Bis(m-tolyl)-3,7-diazaadmantan-9-one, 3,7-DIAZAADAMANTAN-9-ONE, 1,5-BIS(m-TOLYL)-, 1,5-Bis(m-tolyl)-3,7-diazaadamantan-9-one, 5-24-04-00599 (Beilstein Handbook Reference), 5,7-di-m-tolyl-1,3-diazaadamantan-6-one
| Molecular Formula | C22H24N2O |
|---|---|
| Molecular Weight | 332.19 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.18887 |
| Heavy Atoms | 25 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 51808-79-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C23CN4CC(C2=O)(CN(C3)C4)C5=CC=CC(=C5)C |
| InChIKey | WGPQCVBRJDWFHW-UHFFFAOYSA-N |
Product Overview
3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- (CAS 51808-79-8), with molecular formula C22H24N2O and molecular weight 332.19 g/mol. IUPAC: 5,7-bis(3-methylphenyl)-1,3-diazatricyclo[3.3.1.13,7]decan-6-one.
Chemical Property Profile of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-
Property Insights of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-
The XLogP value of 3.2 indicates that 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- has 0 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 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-?
The CAS number of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- is 51808-79-8.
What is the molecular formula of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-?
The molecular formula of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- is C22H24N2O.
What is the molecular weight of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-?
The molecular weight of 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- is 332.19 g/mol.
Where can I buy 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-?
You can request a quote for 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Diazaadamantan-9-one, 1,5-bis(m-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.