3-甲基-2-(3-吡啶基)-1-吲哚辛酸
TL;DR: 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 (CAS 87627-28-9) is a chemical compound with molecular formula C22H26N2O2 and molecular weight 350.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基-2-(3-吡啶基)-1-吲哚辛酸
8-(3-methyl-2-pyridin-3-ylindol-1-yl)octanoic acid
Also Known As: Cgs 12970, 3-Methyl-2-(3-pyridyl)-1-indoleoctanoic acid, 3-methyl-2-1-indoleoctanoicacid, 3-methyl-2- -1-indoleoctanoicacid, 1H-Indole-1-octanoic acid, 3-methyl-2-(3-pyridinyl)-
| Molecular Formula | C22H26N2O2 |
|---|---|
| Molecular Weight | 350.20 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 350.19943 |
| Heavy Atoms | 26 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 87627-28-9 |
|---|---|
| SMILES | CC1=C(N(C2=CC=CC=C12)CCCCCCCC(=O)O)C3=CN=CC=C3 |
| InChIKey | CVVKIXNPXDBREE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲基-2-(3-吡啶基)-1-吲哚辛酸 (CAS 87627-28-9), with molecular formula C22H26N2O2 and molecular weight 350.20 g/mol. IUPAC: 8-(3-methyl-2-pyridin-3-ylindol-1-yl)octanoic acid.
Chemical Property Profile of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸
Property Insights of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸
The XLogP value of 4.5 indicates that 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 has 1 hydrogen bond donor(s) and 3 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 3-甲基-2-(3-吡啶基)-1-吲哚辛酸?
The CAS number of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 is 87627-28-9.
What is the molecular formula of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸?
The molecular formula of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 is C22H26N2O2.
What is the molecular weight of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸?
The molecular weight of 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 is 350.20 g/mol.
Where can I buy 3-甲基-2-(3-吡啶基)-1-吲哚辛酸?
You can request a quote for 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-2-(3-吡啶基)-1-吲哚辛酸?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-2-(3-吡啶基)-1-吲哚辛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.