1H-921
TL;DR: 1H-921 (CAS 321432-10-4) is a chemical compound with molecular formula C22H23ClF3N5O5 and molecular weight 529.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ylidene]hydrazinyl]-6-oxo-1H-pyridine-3,5-dicarboxylate
Also Known As: 1H-921, diethyl 2-(2-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinylidene}hydrazino)-6-hydroxy-3,5-pyridinedicarboxylate, diethyl 2-[2-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene]hydrazinyl]-6-oxo-1H-pyridine-3,5-dicarboxylate, 3,5-diethyl 2-(2-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene}hydrazin-1-yl)-6-hydroxypyridine-3,5-dicarboxylate, 3,5-diethyl2-(2-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene}hydrazin-1-yl)-6-hydroxypyridine-3,5-dicarboxylate
| Molecular Formula | C22H23ClF3N5O5 |
|---|---|
| Molecular Weight | 529.13 g/mol |
| LogP | 3.8638 |
| Topological Polar Surface Area | 125.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 529.134 |
| Heavy Atoms | 36 |
| Complexity | 1221.5303 |
Chemical Identifiers
| CAS Number | 321432-10-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(NC1=O)NN=C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl)C(=O)OCC |
Product Overview
1H-921 (CAS 321432-10-4), with molecular formula C22H23ClF3N5O5 and molecular weight 529.13 g/mol. IUPAC: diethyl 2-[2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ylidene]hydrazinyl]-6-oxo-1H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of 1H-921
Property Insights of 1H-921
The XLogP value of 3.8638 indicates that 1H-921 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-921. Following Lipinski's Rule of Five, 1H-921 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-921?
The CAS number of 1H-921 is 321432-10-4.
What is the molecular formula of 1H-921?
The molecular formula of 1H-921 is C22H23ClF3N5O5.
What is the molecular weight of 1H-921?
The molecular weight of 1H-921 is 529.13 g/mol.
Where can I buy 1H-921?
You can request a quote for 1H-921 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-921?
Yes, KEHONG BIO provides custom synthesis services for 1H-921 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.