7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline
TL;DR: 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline (CAS 87657-26-9) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aS,10bS)-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline-7,9-diol
Also Known As: 7,9-Dobq, 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline, (4aS,10bS)-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline-7,9-diol, 1,2,3,4,4a,5,6,10b-Octahydrobenzo[f]quinoline-7,9-diol, Benzo(f)quinoline-7,9-diol, 1,2,3,4,4a,5,6,10b-octahydro-, trans-
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 52.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 87657-26-9 |
|---|---|
| SMILES | C1C[C@@H]2[C@H](CCC3=C2C=C(C=C3O)O)NC1 |
| InChIKey | RTZCGMQBIRBCHE-CABZTGNLSA-N |
Product Overview
7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline (CAS 87657-26-9), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: (4aS,10bS)-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline-7,9-diol.
Chemical Property Profile of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline
Property Insights of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline. With a topological polar surface area (TPSA) of 52.5 Ų, 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline has 3 hydrogen bond donor(s) and 3 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 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline?
The CAS number of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline is 87657-26-9.
What is the molecular formula of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline?
The molecular formula of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline is C13H17NO2.
What is the molecular weight of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline?
The molecular weight of 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline is 219.13 g/mol.
Where can I buy 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline?
You can request a quote for 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 7,9-Dihydroxy-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.