3K-903
TL;DR: 3K-903 (CAS 338412-85-4) is a chemical compound with molecular formula C19H16ClF3N6O and molecular weight 436.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ylidene]hydrazinyl]-1H-quinoxalin-2-one
Also Known As: 3K-903, 3-(2-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinylidene}hydrazino)-2(1H)-quinoxalinone, 3-[2-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene]hydrazinyl]-1H-quinoxalin-2-one, 3-(2-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-ylidene}hydrazin-1-yl)-1,2-dihydroquinoxalin-2-one
| Molecular Formula | C19H16ClF3N6O |
|---|---|
| Molecular Weight | 436.10 g/mol |
| LogP | 4.0586 |
| Topological Polar Surface Area | 86.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.10263 |
| Heavy Atoms | 30 |
| Complexity | 1166.8789 |
Chemical Identifiers
| CAS Number | 338412-85-4 |
|---|---|
| SMILES | C1CN(CCC1=NNC2=NC3=CC=CC=C3NC2=O)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
3K-903 (CAS 338412-85-4), with molecular formula C19H16ClF3N6O and molecular weight 436.10 g/mol. IUPAC: 3-[2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-ylidene]hydrazinyl]-1H-quinoxalin-2-one.
Chemical Property Profile of 3K-903
Property Insights of 3K-903
The XLogP value of 4.0586 indicates that 3K-903 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 3K-903. Following Lipinski's Rule of Five, 3K-903 has 2 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 3K-903?
The CAS number of 3K-903 is 338412-85-4.
What is the molecular formula of 3K-903?
The molecular formula of 3K-903 is C19H16ClF3N6O.
What is the molecular weight of 3K-903?
The molecular weight of 3K-903 is 436.10 g/mol.
Where can I buy 3K-903?
You can request a quote for 3K-903 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3K-903?
Yes, KEHONG BIO provides custom synthesis services for 3K-903 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.