isopropyl 1H-indole-1-propionate
TL;DR: isopropyl 1H-indole-1-propionate (CAS 93982-57-1) is a chemical compound with molecular formula C14H17NO2 and molecular weight 231.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl 3-indol-1-ylpropanoate
Also Known As: Isopropyl 1H-indole-1-propionate, NCIOpen2_005334, Isopropyl 3-(1H-indol-1-yl)propanoate, propan-2-yl 3-(1h-indol-1-yl)propanoate, propan-2-yl 3-indol-1-ylpropanoate
Technical Specifications
| Molecular Formula | C14H17NO2 |
| Molecular Weight | 231.12593 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 231.12593 Da |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
| SMILES | CC(C)OC(=O)CCN1C=CC2=CC=CC=C21 |
| InChIKey | XLELSJIIIGUXID-UHFFFAOYSA-N |
Chemical Property Profile of isopropyl 1H-indole-1-propionate
Property Insights of isopropyl 1H-indole-1-propionate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for isopropyl 1H-indole-1-propionate. With a topological polar surface area (TPSA) of 31.2 Ų, isopropyl 1H-indole-1-propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, isopropyl 1H-indole-1-propionate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of isopropyl 1H-indole-1-propionate?
The CAS number of isopropyl 1H-indole-1-propionate is 93982-57-1.
What is the molecular formula of isopropyl 1H-indole-1-propionate?
The molecular formula of isopropyl 1H-indole-1-propionate is C14H17NO2.
What is the molecular weight of isopropyl 1H-indole-1-propionate?
The molecular weight of isopropyl 1H-indole-1-propionate is 231.12593 g/mol.
Where can I buy isopropyl 1H-indole-1-propionate?
You can request a quote for isopropyl 1H-indole-1-propionate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for isopropyl 1H-indole-1-propionate?
Yes, CoreyChem provides custom synthesis services for isopropyl 1H-indole-1-propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.