Bionet2_000966
TL;DR: Bionet2_000966 (CAS 37508-41-1) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(3,4-dimethoxyphenyl)ethyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: Bionet2_000966, BAS 00551955, AB00091431-01, 10L-914, BRD-A67830888-001-07-9
| Molecular Formula | C19H21NO4 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 2.0534 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.14706 |
| Heavy Atoms | 24 |
| Complexity | 696.077 |
Chemical Identifiers
| CAS Number | 37508-41-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)C3C4CC(C3C2=O)C=C4)OC |
Product Overview
Bionet2_000966 (CAS 37508-41-1), with molecular formula C19H21NO4 and molecular weight 327.15 g/mol. IUPAC: 4-[2-(3,4-dimethoxyphenyl)ethyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of Bionet2_000966
Property Insights of Bionet2_000966
The XLogP value of 2.0534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet2_000966. With a topological polar surface area (TPSA) of 55.84 Ų, Bionet2_000966 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet2_000966 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 Bionet2_000966?
The CAS number of Bionet2_000966 is 37508-41-1.
What is the molecular formula of Bionet2_000966?
The molecular formula of Bionet2_000966 is C19H21NO4.
What is the molecular weight of Bionet2_000966?
The molecular weight of Bionet2_000966 is 327.15 g/mol.
Where can I buy Bionet2_000966?
You can request a quote for Bionet2_000966 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet2_000966?
Yes, KEHONG BIO provides custom synthesis services for Bionet2_000966 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.