5-21-04-00182 (Beilstein Handbook Reference)
TL;DR: 5-21-04-00182 (Beilstein Handbook Reference) (CAS 69663-48-5) is a chemical compound with molecular formula C23H29NO and molecular weight 335.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,7S,11bS)-2-tert-butyl-7-phenyl-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol
Also Known As: 5-21-04-00182 (Beilstein Handbook Reference), 2-tert-Butyl-1,3,4,6,7,11b-hexahydro-7-phenyl-2H-benzo(a)quinolizin-2-ol, 2H-Benzo(a)quinolizin-2-ol, 1,3,4,6,7,11b-hexahydro-2-(1,1-dimethylethyl)-7-phenyl-, (2S-(2-alpha,7-alpha,11b-alpha)-, (2S,7S,11bS)-2-tert-butyl-7-phenyl-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol, RefChem:1065224
| Molecular Formula | C23H29NO |
|---|---|
| Molecular Weight | 335.22 g/mol |
| LogP | 4.7462 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 335.2249 |
| Heavy Atoms | 25 |
| Complexity | 748.1882 |
Chemical Identifiers
| CAS Number | 69663-48-5 |
|---|---|
| SMILES | CC(C)(C)[C@@]1(CCN2C[C@H](C3=CC=CC=C3[C@@H]2C1)C4=CC=CC=C4)O |
Product Overview
5-21-04-00182 (Beilstein Handbook Reference) (CAS 69663-48-5), with molecular formula C23H29NO and molecular weight 335.22 g/mol. IUPAC: (2S,7S,11bS)-2-tert-butyl-7-phenyl-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ol.
Chemical Property Profile of 5-21-04-00182 (Beilstein Handbook Reference)
Property Insights of 5-21-04-00182 (Beilstein Handbook Reference)
The XLogP value of 4.7462 indicates that 5-21-04-00182 (Beilstein Handbook Reference) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, 5-21-04-00182 (Beilstein Handbook Reference) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-21-04-00182 (Beilstein Handbook Reference) has 1 hydrogen bond donor(s) and 2 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 5-21-04-00182 (Beilstein Handbook Reference)?
The CAS number of 5-21-04-00182 (Beilstein Handbook Reference) is 69663-48-5.
What is the molecular formula of 5-21-04-00182 (Beilstein Handbook Reference)?
The molecular formula of 5-21-04-00182 (Beilstein Handbook Reference) is C23H29NO.
What is the molecular weight of 5-21-04-00182 (Beilstein Handbook Reference)?
The molecular weight of 5-21-04-00182 (Beilstein Handbook Reference) is 335.22 g/mol.
Where can I buy 5-21-04-00182 (Beilstein Handbook Reference)?
You can request a quote for 5-21-04-00182 (Beilstein Handbook Reference) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-21-04-00182 (Beilstein Handbook Reference)?
Yes, KEHONG BIO provides custom synthesis services for 5-21-04-00182 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.