RefChem:1069425
TL;DR: RefChem:1069425 (CAS 151921-11-8) is a chemical compound with molecular formula C24H21ClN6O4S and molecular weight 524.10333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-(2-chlorophenyl)methylideneamino]-3-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]acetyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 4,6(1H,5H)-Pyrimidinedione, dihydro-1-(((2-chlorophenyl)methylene)amino)-3-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)acetyl)-2-thioxo-, 1-[[[(1,5-Dimethyl-2-phenyl-3-oxo-2,3-dihydro-1H-pyrazol)-4-yl]amino]acetyl]-2-thioxo-3-[(2-chlorobenzylidene)amino]dihydropyrimidine-4,6(1H,5H)-dione, 1-{[(2-chlorophenyl)methylidene]amino}-3-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]acetyl}-2-sulfanylidene-1,3-diazinane-4,6-dione
Technical Specifications
| Molecular Formula | C24H21ClN6O4S |
| Molecular Weight | 524.10333 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 524.10333 Da |
| Heavy Atoms | 36 |
| Complexity | 1010.0 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCC(=O)N3C(=O)CC(=O)N(C3=S)/N=C/C4=CC=CC=C4Cl |
| InChIKey | PQKBRZZDQFCGCV-UVHMKAGCSA-N |
Chemical Property Profile of RefChem:1069425
Property Insights of RefChem:1069425
The XLogP value of 3.8 indicates that RefChem:1069425 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1069425. Following Lipinski's Rule of Five, RefChem:1069425 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1069425?
The CAS number of RefChem:1069425 is 151921-11-8.
What is the molecular formula of RefChem:1069425?
The molecular formula of RefChem:1069425 is C24H21ClN6O4S.
What is the molecular weight of RefChem:1069425?
The molecular weight of RefChem:1069425 is 524.10333 g/mol.
Where can I buy RefChem:1069425?
You can request a quote for RefChem:1069425 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1069425?
Yes, CoreyChem provides custom synthesis services for RefChem:1069425 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.