RefChem:238237
TL;DR: RefChem:238237 (CAS 105579-57-5) is a chemical compound with molecular formula C23H28N4O2 and molecular weight 392.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]methyl]-5-methylimidazole-4-carboxylate
Also Known As: 1H-Imidazole-4-carboxylic acid, 5-methyl-1-(((8-beta)-6-methylergolin-8-yl)methyl)-, ethyl ester, Ethyl 5-methyl-1-[(6-methylergolin-8-yl)methyl]-1H-imidazole-4-carboxylate, Ethyl 5-methyl-1-{[(10xi)-6-methylergolin-8beta-yl]methyl}-1H-imidazole-4-carboxylate, RefChem:238237
| Molecular Formula | C23H28N4O2 |
|---|---|
| Molecular Weight | 392.22 g/mol |
| LogP | 3.50972 |
| Topological Polar Surface Area | 63.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.22122 |
| Heavy Atoms | 29 |
| Complexity | 1066.2025 |
Chemical Identifiers
| CAS Number | 105579-57-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C=N1)C[C@@H]2CC3[C@@H](CC4=CNC5=CC=CC3=C45)N(C2)C)C |
Product Overview
RefChem:238237 (CAS 105579-57-5), with molecular formula C23H28N4O2 and molecular weight 392.22 g/mol. IUPAC: ethyl 1-[[(6aR,9R)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]methyl]-5-methylimidazole-4-carboxylate.
Chemical Property Profile of RefChem:238237
Property Insights of RefChem:238237
The XLogP value of 3.50972 indicates that RefChem:238237 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.15 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:238237. Following Lipinski's Rule of Five, RefChem:238237 has 1 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:238237?
The CAS number of RefChem:238237 is 105579-57-5.
What is the molecular formula of RefChem:238237?
The molecular formula of RefChem:238237 is C23H28N4O2.
What is the molecular weight of RefChem:238237?
The molecular weight of RefChem:238237 is 392.22 g/mol.
Where can I buy RefChem:238237?
You can request a quote for RefChem:238237 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:238237?
Yes, KEHONG BIO provides custom synthesis services for RefChem:238237 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.