1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea
TL;DR: 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea (CAS 13094-44-5) is a chemical compound with molecular formula C13H11ClN4OS and molecular weight 306.0342 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea
Also Known As: Maybridge1_005318, 1-(3-chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea, ML 00381, 3-(3-chlorophenyl)-1-(pyridine-4-carbonylamino)thiourea, 4-Pyridinecarboxylic acid, 2-[[(3-chlorophenyl)amino]thioxomethyl]hydrazide
Technical Specifications
| Molecular Formula | C13H11ClN4OS |
| Molecular Weight | 306.0342 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 98.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.0342 Da |
| Heavy Atoms | 20 |
| Complexity | 349.0 |
| SMILES | C1=CC(=CC(=C1)Cl)NC(=S)NNC(=O)C2=CC=NC=C2 |
| InChIKey | FFHIKXXAROVKKM-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea
Property Insights of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea. Following Lipinski's Rule of Five, 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea?
The CAS number of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea is 13094-44-5.
What is the molecular formula of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea?
The molecular formula of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea is C13H11ClN4OS.
What is the molecular weight of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea?
The molecular weight of 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea is 306.0342 g/mol.
Where can I buy 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea?
You can request a quote for 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea?
Yes, CoreyChem provides custom synthesis services for 1-(3-Chlorophenyl)-3-(pyridine-4-carbonylamino)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.