4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol
TL;DR: 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol (CAS 878441-53-3) is a chemical compound with molecular formula C20H30N2O3 and molecular weight 346.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-hydroxy-5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-2-yl)benzene-1,3-diol
Also Known As: BAS 13775995, 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol, 4-(6-hydroxy-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)benzene-1,3-diol
| Molecular Formula | C20H30N2O3 |
|---|---|
| Molecular Weight | 346.23 g/mol |
| LogP | 2.6751 |
| Topological Polar Surface Area | 67.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.22565 |
| Heavy Atoms | 25 |
| Complexity | 620.3414 |
Chemical Identifiers
| CAS Number | 878441-53-3 |
|---|---|
| SMILES | CCCC12CN3CC(C1O)(CN(C2)C3C4=C(C=C(C=C4)O)O)CCC |
Product Overview
4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol (CAS 878441-53-3), with molecular formula C20H30N2O3 and molecular weight 346.23 g/mol. IUPAC: 4-(6-hydroxy-5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-2-yl)benzene-1,3-diol.
Chemical Property Profile of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol
Property Insights of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol
The XLogP value of 2.6751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol. The TPSA of 67.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol. Following Lipinski's Rule of Five, 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol has 3 hydrogen bond donor(s) and 5 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 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
The CAS number of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol is 878441-53-3.
What is the molecular formula of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
The molecular formula of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol is C20H30N2O3.
What is the molecular weight of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
The molecular weight of 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol is 346.23 g/mol.
Where can I buy 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
You can request a quote for 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-((1r,5R,7S)-6-hydroxy-5,7-dipropyl-1,3-diazaadamantan-2-yl)benzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.