2,5-二甲基-3-吲哚丙酸
TL;DR: 2,5-二甲基-3-吲哚丙酸 (CAS 73816-53-2) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11 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
3-(2,5-dimethyl-1H-indol-3-yl)propanoic acid
Also Known As: 2,5-Dimethyl-3-indolepropionic acid, 3-INDOLEPROPIONIC ACID, 2,5-DIMETHYL-, 3-(2,5-dimethyl-1H-indol-3-yl)propanoic acid, 1H-Indole-3-propanoic acid, 2,5-dimethyl-, RefChem:279995
| Molecular Formula | C13H15NO2 |
|---|---|
| Molecular Weight | 217.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.11028 |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 73816-53-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=C2CCC(=O)O)C |
| InChIKey | OXLKRUQISCGSMH-UHFFFAOYSA-N |
Product Overview
2,5-二甲基-3-吲哚丙酸 (CAS 73816-53-2), with molecular formula C13H15NO2 and molecular weight 217.11 g/mol. IUPAC: 3-(2,5-dimethyl-1H-indol-3-yl)propanoic acid.
Chemical Property Profile of 2,5-二甲基-3-吲哚丙酸
Property Insights of 2,5-二甲基-3-吲哚丙酸
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-二甲基-3-吲哚丙酸. With a topological polar surface area (TPSA) of 53.1 Ų, 2,5-二甲基-3-吲哚丙酸 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 has 2 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?
The CAS number of 2,5-二甲基-3-吲哚丙酸 is 73816-53-2.
What is the molecular formula of 2,5-二甲基-3-吲哚丙酸?
The molecular formula of 2,5-二甲基-3-吲哚丙酸 is C13H15NO2.
What is the molecular weight of 2,5-二甲基-3-吲哚丙酸?
The molecular weight of 2,5-二甲基-3-吲哚丙酸 is 217.11 g/mol.
Where can I buy 2,5-二甲基-3-吲哚丙酸?
You can request a quote for 2,5-二甲基-3-吲哚丙酸 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?
Yes, KEHONG BIO provides custom synthesis services for 2,5-二甲基-3-吲哚丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.