1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-
TL;DR: 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- (CAS 108790-56-3) is a chemical compound with molecular formula C16H20N2O2 and molecular weight 272.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-one
Also Known As: ChemDiv1_021136, BAS 00334608, 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-, 2-(2-hydroxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one, A0782/0036624
| Molecular Formula | C16H20N2O2 |
|---|---|
| Molecular Weight | 272.15 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.15247 |
| Heavy Atoms | 20 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 108790-56-3 |
|---|---|
| SMILES | CC12CN3CC(C1=O)(CN(C2)C3C4=CC=CC=C4O)C |
| InChIKey | SGFFLFVMSJCBFH-UHFFFAOYSA-N |
Product Overview
1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- (CAS 108790-56-3), with molecular formula C16H20N2O2 and molecular weight 272.15 g/mol. IUPAC: 2-(2-hydroxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-one.
Chemical Property Profile of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-
Property Insights of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-. With a topological polar surface area (TPSA) of 43.8 Ų, 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- 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 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-?
The CAS number of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- is 108790-56-3.
What is the molecular formula of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-?
The molecular formula of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- is C16H20N2O2.
What is the molecular weight of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-?
The molecular weight of 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- is 272.15 g/mol.
Where can I buy 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-?
You can request a quote for 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.