8L-929
TL;DR: 8L-929 (CAS 339101-57-4) is a chemical compound with molecular formula C18H16ClF3N4O3 and molecular weight 428.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carbonyl]pyridine-4-carboxylate
Also Known As: 8L-929, methyl 3-({4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}carbonyl)isonicotinate, Methyl 3-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl]pyridine-4-carboxylate, methyl 3-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl}pyridine-4-carboxylate, methyl3-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl}pyridine-4-carboxylate
| Molecular Formula | C18H16ClF3N4O3 |
|---|---|
| Molecular Weight | 428.09 g/mol |
| LogP | 2.8978 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.0863 |
| Heavy Atoms | 29 |
| Complexity | 930.8076 |
Chemical Identifiers
| CAS Number | 339101-57-4 |
|---|---|
| SMILES | COC(=O)C1=C(C=NC=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
8L-929 (CAS 339101-57-4), with molecular formula C18H16ClF3N4O3 and molecular weight 428.09 g/mol. IUPAC: methyl 3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carbonyl]pyridine-4-carboxylate.
Chemical Property Profile of 8L-929
Property Insights of 8L-929
The XLogP value of 2.8978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8L-929. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 8L-929. Following Lipinski's Rule of Five, 8L-929 has 0 hydrogen bond donor(s) and 6 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 8L-929?
The CAS number of 8L-929 is 339101-57-4.
What is the molecular formula of 8L-929?
The molecular formula of 8L-929 is C18H16ClF3N4O3.
What is the molecular weight of 8L-929?
The molecular weight of 8L-929 is 428.09 g/mol.
Where can I buy 8L-929?
You can request a quote for 8L-929 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8L-929?
Yes, KEHONG BIO provides custom synthesis services for 8L-929 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.