2,5-二甲基-3-吲哚丙酸乙酯
TL;DR: 2,5-二甲基-3-吲哚丙酸乙酯 (CAS 73816-54-3) is a chemical compound with molecular formula C15H19NO2 and molecular weight 245.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-二甲基-3-吲哚丙酸乙酯
ethyl 3-(2,5-dimethyl-1H-indol-3-yl)propanoate
Also Known As: Ethyl 2,5-dimethyl-3-indolepropionate, 3-INDOLEPROPIONIC ACID, 2,5-DIMETHYL-, ETHYL ESTER, ethyl 3-(2,5-dimethyl-1H-indol-3-yl)propanoate, 1H-Indole-3-propanoic acid, 2,5-dimethyl-, ethyl ester, RefChem:279996
| Molecular Formula | C15H19NO2 |
|---|---|
| Molecular Weight | 245.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.14159 |
| Heavy Atoms | 18 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 73816-54-3 |
|---|---|
| SMILES | CCOC(=O)CCC1=C(NC2=C1C=C(C=C2)C)C |
| InChIKey | TVTGQAHJXZEAMP-UHFFFAOYSA-N |
Product Overview
2,5-二甲基-3-吲哚丙酸乙酯 (CAS 73816-54-3), with molecular formula C15H19NO2 and molecular weight 245.14 g/mol. IUPAC: ethyl 3-(2,5-dimethyl-1H-indol-3-yl)propanoate.
Chemical Property Profile of 2,5-二甲基-3-吲哚丙酸乙酯
Property Insights of 2,5-二甲基-3-吲哚丙酸乙酯
The XLogP value of 3.3 indicates that 2,5-二甲基-3-吲哚丙酸乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.1 Ų, 2,5-二甲基-3-吲哚丙酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-二甲基-3-吲哚丙酸乙酯 has 1 hydrogen bond donor(s) and 2 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 2,5-二甲基-3-吲哚丙酸乙酯?
The CAS number of 2,5-二甲基-3-吲哚丙酸乙酯 is 73816-54-3.
What is the molecular formula of 2,5-二甲基-3-吲哚丙酸乙酯?
The molecular formula of 2,5-二甲基-3-吲哚丙酸乙酯 is C15H19NO2.
What is the molecular weight of 2,5-二甲基-3-吲哚丙酸乙酯?
The molecular weight of 2,5-二甲基-3-吲哚丙酸乙酯 is 245.14 g/mol.
Where can I buy 2,5-二甲基-3-吲哚丙酸乙酯?
You can request a quote for 2,5-二甲基-3-吲哚丙酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-二甲基-3-吲哚丙酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 2,5-二甲基-3-吲哚丙酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.