ChemDiv1_005503
TL;DR: ChemDiv1_005503 (CAS 347368-75-6) is a chemical compound with molecular formula C27H34N2O4 and molecular weight 450.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-benzyl-5-(2-hydroxy-3-piperidin-1-ylpropoxy)-2-methylindole-3-carboxylate
Also Known As: ChemDiv1_005503, F1021-0652, ethyl 1-benzyl-5-(2-hydroxy-3-(piperidin-1-yl)propoxy)-2-methyl-1H-indole-3-carboxylate, 1-Benzyl-5-(2-hydroxy-3-piperidin-1-yl-propoxy)-2-methyl-1H-indole-3-carboxylic acid ethyl ester, ethyl 1-benzyl-5-(2-hydroxy-3-piperidin-1-ylpropoxy)-2-methylindole-3-carboxylate
| Molecular Formula | C27H34N2O4 |
|---|---|
| Molecular Weight | 450.25 g/mol |
| LogP | 4.40032 |
| Topological Polar Surface Area | 63.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.25186 |
| Heavy Atoms | 33 |
| Complexity | 1070.6649 |
Chemical Identifiers
| CAS Number | 347368-75-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCCCC3)O)CC4=CC=CC=C4)C |
Product Overview
ChemDiv1_005503 (CAS 347368-75-6), with molecular formula C27H34N2O4 and molecular weight 450.25 g/mol. IUPAC: ethyl 1-benzyl-5-(2-hydroxy-3-piperidin-1-ylpropoxy)-2-methylindole-3-carboxylate.
Chemical Property Profile of ChemDiv1_005503
Property Insights of ChemDiv1_005503
The XLogP value of 4.40032 indicates that ChemDiv1_005503 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.93 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005503. Following Lipinski's Rule of Five, ChemDiv1_005503 has 1 hydrogen bond donor(s) and 5 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 ChemDiv1_005503?
The CAS number of ChemDiv1_005503 is 347368-75-6.
What is the molecular formula of ChemDiv1_005503?
The molecular formula of ChemDiv1_005503 is C27H34N2O4.
What is the molecular weight of ChemDiv1_005503?
The molecular weight of ChemDiv1_005503 is 450.25 g/mol.
Where can I buy ChemDiv1_005503?
You can request a quote for ChemDiv1_005503 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005503?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005503 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.