Trpc6-IN-1
TL;DR: Trpc6-IN-1 (CAS 901715-05-7) is a chemical compound with molecular formula C21H23FN4O3 and molecular weight 398.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(4-fluorophenyl)-2-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate
Also Known As: ethyl 4-[3-(4-fluorophenyl)-2-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate, 4-[3-(4-fluorophenyl)-2-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]-1-piperidinecarboxylic acid ethyl ester, 1-Piperidinecarboxylic acid, 4-[3-(4-fluorophenyl)-7-hydroxy-2-methylpyrazolo[1,5-a]pyrimidin-5-yl]-, ethyl ester, Ethyl 4-(3-(4-fluorophenyl)-7-hydroxy-2-methylpyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate, N/A
| Molecular Formula | C21H23FN4O3 |
|---|---|
| Molecular Weight | 398.18 g/mol |
| LogP | 3.47302 |
| Topological Polar Surface Area | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.1754 |
| Heavy Atoms | 29 |
| Complexity | 1095.552 |
Chemical Identifiers
| CAS Number | 901715-05-7 |
|---|---|
| SMILES | CCOC(=O)N1CCC(CC1)C2=CC(=O)N3C(=N2)C(=C(N3)C)C4=CC=C(C=C4)F |
Product Overview
Trpc6-IN-1 (CAS 901715-05-7), with molecular formula C21H23FN4O3 and molecular weight 398.18 g/mol. IUPAC: ethyl 4-[3-(4-fluorophenyl)-2-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylate.
Chemical Property Profile of Trpc6-IN-1
Property Insights of Trpc6-IN-1
The XLogP value of 3.47302 indicates that Trpc6-IN-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Trpc6-IN-1. Following Lipinski's Rule of Five, Trpc6-IN-1 has 1 hydrogen bond donor(s) and 4 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 Trpc6-IN-1?
The CAS number of Trpc6-IN-1 is 901715-05-7.
What is the molecular formula of Trpc6-IN-1?
The molecular formula of Trpc6-IN-1 is C21H23FN4O3.
What is the molecular weight of Trpc6-IN-1?
The molecular weight of Trpc6-IN-1 is 398.18 g/mol.
Where can I buy Trpc6-IN-1?
You can request a quote for Trpc6-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trpc6-IN-1?
Yes, KEHONG BIO provides custom synthesis services for Trpc6-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.