AB01304430-01
TL;DR: AB01304430-01 (CAS 906261-20-9) is a chemical compound with molecular formula C20H27BrN2O2 and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-2-ethoxyphenyl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-one
Also Known As: AB01304430-01, (5s,7s)-2-(5-bromo-2-ethoxyphenyl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one, (1r,5R,7S)-2-(5-bromo-2-ethoxyphenyl)-5,7-diethyl-1,3-diazaadamantan-6-one, 2-(5-bromo-2-ethoxyphenyl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
| Molecular Formula | C20H27BrN2O2 |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 3.8531 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.12558 |
| Heavy Atoms | 25 |
| Complexity | 662.9366 |
Chemical Identifiers
| CAS Number | 906261-20-9 |
|---|---|
| SMILES | CCC12CN3CC(C1=O)(CN(C2)C3C4=C(C=CC(=C4)Br)OCC)CC |
Product Overview
AB01304430-01 (CAS 906261-20-9), with molecular formula C20H27BrN2O2 and molecular weight 406.13 g/mol. IUPAC: 2-(5-bromo-2-ethoxyphenyl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.13,7]decan-6-one.
Chemical Property Profile of AB01304430-01
Property Insights of AB01304430-01
The XLogP value of 3.8531 indicates that AB01304430-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, AB01304430-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01304430-01 has 0 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 AB01304430-01?
The CAS number of AB01304430-01 is 906261-20-9.
What is the molecular formula of AB01304430-01?
The molecular formula of AB01304430-01 is C20H27BrN2O2.
What is the molecular weight of AB01304430-01?
The molecular weight of AB01304430-01 is 406.13 g/mol.
Where can I buy AB01304430-01?
You can request a quote for AB01304430-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01304430-01?
Yes, KEHONG BIO provides custom synthesis services for AB01304430-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.