1H-吲哚-1-丙酰胺
TL;DR: 1H-吲哚-1-丙酰胺 (CAS 21017-50-5) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-吲哚-1-丙酰胺
3-indol-1-ylpropanamide
Also Known As: 3-(1H-indol-1-yl)propanamide, 1H-Indole-1-propionamide, 1H-Indole-1-propanamide, Indole-1-propionamide, 3-indol-1-ylpropanamide
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
| Solubility | >28.2 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 21017-50-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN2CCC(=O)N |
| InChIKey | VITGGSSBWKUFGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-吲哚-1-丙酰胺 (CAS 21017-50-5), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 3-indol-1-ylpropanamide.
Chemical Property Profile of 1H-吲哚-1-丙酰胺
Property Insights of 1H-吲哚-1-丙酰胺
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-吲哚-1-丙酰胺. With a topological polar surface area (TPSA) of 48.0 Ų, 1H-吲哚-1-丙酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-吲哚-1-丙酰胺 has 1 hydrogen bond donor(s) and 1 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 1H-吲哚-1-丙酰胺?
The CAS number of 1H-吲哚-1-丙酰胺 is 21017-50-5.
What is the molecular formula of 1H-吲哚-1-丙酰胺?
The molecular formula of 1H-吲哚-1-丙酰胺 is C11H12N2O.
What is the molecular weight of 1H-吲哚-1-丙酰胺?
The molecular weight of 1H-吲哚-1-丙酰胺 is 188.09 g/mol.
Where can I buy 1H-吲哚-1-丙酰胺?
You can request a quote for 1H-吲哚-1-丙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-吲哚-1-丙酰胺?
Yes, KEHONG BIO provides custom synthesis services for 1H-吲哚-1-丙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.