RefChem:322867
TL;DR: RefChem:322867 (CAS 88763-42-2) is a chemical compound with molecular formula C20H24N2O2 and molecular weight 324.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4aS,5R,9bS)-7,8-dimethoxy-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl]aniline
Also Known As: Benzenamine, 4-(2,3,4,4a,5,9b-hexahydro-7,8-dimethoxy-1H-indeno(1,2-b)pyridin-5-yl)-, (4a-alpha,5-beta,9b-alpha)-, 4-[(4aS,5R,9bS)-7,8-dimethoxy-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl]aniline, 4-(7,8-Dimethoxy-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl)aniline, BRN 4711527, RefChem:322867
| Molecular Formula | C20H24N2O2 |
|---|---|
| Molecular Weight | 324.18 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.18378 |
| Heavy Atoms | 24 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 88763-42-2 |
|---|---|
| SMILES | COC1=C(C=C2[C@@H]3[C@@H](CCCN3)[C@@H](C2=C1)C4=CC=C(C=C4)N)OC |
| InChIKey | UTQZYUJKGSTGHD-GKCIPKSASA-N |
Product Overview
RefChem:322867 (CAS 88763-42-2), with molecular formula C20H24N2O2 and molecular weight 324.18 g/mol. IUPAC: 4-[(4aS,5R,9bS)-7,8-dimethoxy-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl]aniline.
Chemical Property Profile of RefChem:322867
Property Insights of RefChem:322867
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:322867. With a topological polar surface area (TPSA) of 56.5 Ų, RefChem:322867 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:322867 has 2 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 RefChem:322867?
The CAS number of RefChem:322867 is 88763-42-2.
What is the molecular formula of RefChem:322867?
The molecular formula of RefChem:322867 is C20H24N2O2.
What is the molecular weight of RefChem:322867?
The molecular weight of RefChem:322867 is 324.18 g/mol.
Where can I buy RefChem:322867?
You can request a quote for RefChem:322867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322867?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.