1-(2,4-Dichlorobenzylidene) thiosemicarbazide
TL;DR: 1-(2,4-Dichlorobenzylidene) thiosemicarbazide (CAS 6957-92-2) is a chemical compound with molecular formula C8H7Cl2N3S and molecular weight 246.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2,4-dichlorophenyl)methylideneamino]thiourea
Also Known As: 2,4-Dichlorobenzaldehyde thiosemicarbazone, [(2,4-dichlorophenyl)methylideneamino]thiourea, 1-(2,4-dichlorobenzylidene) thiosemicarbazide
| Molecular Formula | C8H7Cl2N3S |
|---|---|
| Molecular Weight | 246.97 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.97377 |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 6957-92-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C=NNC(=S)N |
| InChIKey | RGHAHEATEPYSTR-UHFFFAOYSA-N |
Product Overview
1-(2,4-Dichlorobenzylidene) thiosemicarbazide (CAS 6957-92-2), with molecular formula C8H7Cl2N3S and molecular weight 246.97 g/mol. IUPAC: [(2,4-dichlorophenyl)methylideneamino]thiourea.
Chemical Property Profile of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide
Property Insights of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dichlorobenzylidene) thiosemicarbazide. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dichlorobenzylidene) thiosemicarbazide. Following Lipinski's Rule of Five, 1-(2,4-Dichlorobenzylidene) thiosemicarbazide has 2 hydrogen bond donor(s) and 2 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 1-(2,4-Dichlorobenzylidene) thiosemicarbazide?
The CAS number of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide is 6957-92-2.
What is the molecular formula of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide?
The molecular formula of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide is C8H7Cl2N3S.
What is the molecular weight of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide?
The molecular weight of 1-(2,4-Dichlorobenzylidene) thiosemicarbazide is 246.97 g/mol.
Where can I buy 1-(2,4-Dichlorobenzylidene) thiosemicarbazide?
You can request a quote for 1-(2,4-Dichlorobenzylidene) thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Dichlorobenzylidene) thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dichlorobenzylidene) thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.