p-CHLOROPHENYL-4-THIOSEMICARBAZIDE
TL;DR: p-CHLOROPHENYL-4-THIOSEMICARBAZIDE (CAS 116989-71-0) is a chemical compound with molecular formula C23H15BrN6S and molecular weight 486.02625 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-bromophenyl)-3-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1H-1,2,4-triazole-5-thione
Also Known As: p-CHLOROPHENYL-4-THIOSEMICARBAZIDE, 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-bromophenyl)-5-(6H-indolo(2,3-b)quinoxalin-6-ylmethyl)-, 4-(4-bromophenyl)-3-(indolo[3,2-b]quinoxalin-6-ylmethyl)-1H-1,2,4-triazole-5-thione, 3H-1,2,4-Triazole-3-thione,4-(4-bromophenyl)-2,4-dihydro-5-(6H-indolo[2,3-b]quinoxalin-6-ylmethyl)-, 4-(4-Bromophenyl)-5-[(6H-indolo[2,3-b]quinoxalin-6-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Technical Specifications
| Molecular Formula | C23H15BrN6S |
| Molecular Weight | 486.02625 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 90.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 486.02625 Da |
| Heavy Atoms | 31 |
| Complexity | 725.0 |
| SMILES | C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N=C3N2CC5=NNC(=S)N5C6=CC=C(C=C6)Br |
| InChIKey | WUVCCFLXOSXDSX-UHFFFAOYSA-N |
Chemical Property Profile of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE
Property Insights of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE
The XLogP value of 5.2 indicates that p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.4 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 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
The CAS number of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is 116989-71-0.
What is the molecular formula of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
The molecular formula of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is C23H15BrN6S.
What is the molecular weight of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE?
The molecular weight of p-CHLOROPHENYL-4-THIOSEMICARBAZIDE is 486.02625 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.