BAS 08768463
TL;DR: BAS 08768463 (CAS 322476-14-2) is a chemical compound with molecular formula C21H23NO4 and molecular weight 353.16 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-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione
Also Known As: BAS 08768463, 2-[2-(3,4-dimethoxyphenyl)ethyl]hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, (3aR,4S,4aS,5aR,6R,6aS)-2-(3,4-dimethoxyphenethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 2-(3,4-dimethoxyphenethyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione, 4-[2-(3,4-dimethoxyphenyl)ethyl]-4-azatetracyclo[5.3.2.0<2,6>.0<8,10>]dodec-11 -ene-3,5-dione
| Molecular Formula | C21H23NO4 |
|---|---|
| Molecular Weight | 353.16 g/mol |
| LogP | 2.2994 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.16272 |
| Heavy Atoms | 26 |
| Complexity | 780.2291 |
Chemical Identifiers
| CAS Number | 322476-14-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)C3C4C=CC(C3C2=O)C5C4C5)OC |
Product Overview
BAS 08768463 (CAS 322476-14-2), with molecular formula C21H23NO4 and molecular weight 353.16 g/mol. IUPAC: 4-[2-(3,4-dimethoxyphenyl)ethyl]-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione.
Chemical Property Profile of BAS 08768463
Property Insights of BAS 08768463
The XLogP value of 2.2994 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08768463. With a topological polar surface area (TPSA) of 55.84 Ų, BAS 08768463 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 08768463 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 BAS 08768463?
The CAS number of BAS 08768463 is 322476-14-2.
What is the molecular formula of BAS 08768463?
The molecular formula of BAS 08768463 is C21H23NO4.
What is the molecular weight of BAS 08768463?
The molecular weight of BAS 08768463 is 353.16 g/mol.
Where can I buy BAS 08768463?
You can request a quote for BAS 08768463 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08768463?
Yes, KEHONG BIO provides custom synthesis services for BAS 08768463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.