RefChem:205087
TL;DR: RefChem:205087 (CAS 138922-22-2) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,9R)-11-hydroxy-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
Also Known As: (-)-12-Hydroxycytisine, (1R,5R)-1,2,3,4,5,6-Hexahydro-3-hydroxy-1,5-methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, (1R,9R)-11-hydroxy-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one, (1R,5R)-1,2,3,4,5,6-Hexahydro-3-hydroxy-1,5-methano-8H-pyrido(1,2-a)(1,5)diazocin-8-one, (1R,5R)-3-hydroxy-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
| Molecular Formula | C11H14N2O2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 0.6566 |
| Topological Polar Surface Area | 45.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.10553 |
| Heavy Atoms | 15 |
| Complexity | 440.45923 |
Chemical Identifiers
| CAS Number | 138922-22-2 |
|---|---|
| SMILES | C1[C@H]2CN(C[C@@H]1C3=CC=CC(=O)N3C2)O |
Product Overview
RefChem:205087 (CAS 138922-22-2), with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol. IUPAC: (1R,9R)-11-hydroxy-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one.
Chemical Property Profile of RefChem:205087
Property Insights of RefChem:205087
The XLogP value of 0.6566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:205087. With a topological polar surface area (TPSA) of 45.47 Ų, RefChem:205087 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:205087 has 1 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 RefChem:205087?
The CAS number of RefChem:205087 is 138922-22-2.
What is the molecular formula of RefChem:205087?
The molecular formula of RefChem:205087 is C11H14N2O2.
What is the molecular weight of RefChem:205087?
The molecular weight of RefChem:205087 is 206.11 g/mol.
Where can I buy RefChem:205087?
You can request a quote for RefChem:205087 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:205087?
Yes, KEHONG BIO provides custom synthesis services for RefChem:205087 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.