F0122-0004
TL;DR: F0122-0004 (CAS 361186-08-5) is a chemical compound with molecular formula C21H17ClN4O and molecular weight 376.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-chloroquinolin-3-yl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: F0122-0004, (E)-4-(((2-chloroquinolin-3-yl)methylene)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-[(E)-[(2-chloroquinolin-3-yl)methylidene]amino]-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one, 4-[(2-chloroquinolin-3-yl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one, 4-[(2-chloroquinolin-3-yl)methyleneamino]-1,5-dimethyl-2-phenyl-1h-pyrazol-3(2h)-one
| Molecular Formula | C21H17ClN4O |
|---|---|
| Molecular Weight | 376.11 g/mol |
| LogP | 4.43662 |
| Topological Polar Surface Area | 52.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.1091 |
| Heavy Atoms | 27 |
| Complexity | 1222.3945 |
Chemical Identifiers
| CAS Number | 361186-08-5 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC4=CC=CC=C4N=C3Cl |
Product Overview
F0122-0004 (CAS 361186-08-5), with molecular formula C21H17ClN4O and molecular weight 376.11 g/mol. IUPAC: 4-[(2-chloroquinolin-3-yl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of F0122-0004
Property Insights of F0122-0004
The XLogP value of 4.43662 indicates that F0122-0004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.18 Ų, F0122-0004 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0122-0004 has 0 hydrogen bond donor(s) and 3 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 F0122-0004?
The CAS number of F0122-0004 is 361186-08-5.
What is the molecular formula of F0122-0004?
The molecular formula of F0122-0004 is C21H17ClN4O.
What is the molecular weight of F0122-0004?
The molecular weight of F0122-0004 is 376.11 g/mol.
Where can I buy F0122-0004?
You can request a quote for F0122-0004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0122-0004?
Yes, KEHONG BIO provides custom synthesis services for F0122-0004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.