烟氢可待因
TL;DR: 烟氢可待因 (CAS 808-24-2) is a chemical compound with molecular formula C24H26N2O4 and molecular weight 406.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
烟氢可待因
[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] pyridine-3-carboxylate
Also Known As: Nicodicodine, Nicodicodina, Nicodicodinum, Nicodicodin, Nicodicodina [DCIT]
| Molecular Formula | C24H26N2O4 |
|---|---|
| Molecular Weight | 406.19 g/mol |
| LogP | 2.9848 |
| Topological Polar Surface Area | 60.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.18927 |
| Heavy Atoms | 30 |
| Complexity | 1009.76556 |
Chemical Identifiers
| CAS Number | 808-24-2 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](CC4)OC(=O)C6=CN=CC=C6 |
Product Overview
烟氢可待因 (CAS 808-24-2), with molecular formula C24H26N2O4 and molecular weight 406.19 g/mol. IUPAC: [(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] pyridine-3-carboxylate.
Chemical Property Profile of 烟氢可待因
Property Insights of 烟氢可待因
The XLogP value of 2.9848 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 烟氢可待因. The TPSA of 60.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 烟氢可待因. Following Lipinski's Rule of Five, 烟氢可待因 has 0 hydrogen bond donor(s) and 6 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 烟氢可待因?
The CAS number of 烟氢可待因 is 808-24-2.
What is the molecular formula of 烟氢可待因?
The molecular formula of 烟氢可待因 is C24H26N2O4.
What is the molecular weight of 烟氢可待因?
The molecular weight of 烟氢可待因 is 406.19 g/mol.
Where can I buy 烟氢可待因?
You can request a quote for 烟氢可待因 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 烟氢可待因?
Yes, KEHONG BIO provides custom synthesis services for 烟氢可待因 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.