p-CHLOROPHENYL-4-THIOSEMICARBAZIDE
TL;DR: p-CHLOROPHENYL-4-THIOSEMICARBAZIDE (CAS 116989-76-5) is a chemical compound with molecular formula C25H18N6O2S and molecular weight 466.1212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
Also Known As: p-CHLOROPHENYL-4-THIOSEMICARBAZIDE, Acetic acid, ((5-((6H-indolo(2,3-b)quinoxalin-6-yl)methyl)-1-phenyl-1H-1,3,4-triazol-2-yl)thio)-, N(sup 6)-((4-Phenyl-5-mercaptoacetic acid-1,2,4-triazol-3-yl)methylene)indophenazine, 2-[[5-(indolo[3,2-b]quinoxalin-6-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid, Acetic acid,2-[[5-(6H-indolo[2,3-b]quinoxalin-6-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-
Technical Specifications
| Molecular Formula | C25H18N6O2S |
| Molecular Weight | 466.1212 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 466.1212 Da |
| Heavy Atoms | 34 |
| Complexity | 724.0 |
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)CN3C4=CC=CC=C4C5=NC6=CC=CC=C6N=C53 |
| InChIKey | SITIYSUYYINOIZ-UHFFFAOYSA-N |
Chemical Property Profile of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE
Property Insights of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE
The XLogP value of 4.0 indicates that p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for p-CHLOROPHENYL-4-THIOSEMICARBAZIDE. Following Lipinski's Rule of Five, p-CHLOROPHENYL-4-THIOSEMICARBAZIDE has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
The CAS number of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is 116989-76-5.
What is the molecular formula of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
The molecular formula of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is C25H18N6O2S.
What is the molecular weight of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
The molecular weight of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is 466.1212 g/mol.
Where can I buy p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
You can request a quote for p-CHLOROPHENYL-4-THIOSEMICARBAZIDE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
Yes, CoreyChem provides custom synthesis services for p-CHLOROPHENYL-4-THIOSEMICARBAZIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.