2,6-Dichlorobenzaldehyde thiosemicarbazone
TL;DR: 2,6-Dichlorobenzaldehyde thiosemicarbazone (CAS 88141-27-9) 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.
[(E)-(2,6-dichlorophenyl)methylideneamino]thiourea
Also Known As: 2,6-Dichlorobenzaldehyde thiosemicarbazone, 2,6-dichlorobenzaldehyde hydrazone, [(2,6-dichlorophenyl)methylideneamino]thiourea, 2,6-Dichlorobenzaldehydethiosemicarbazone, [(E)-(2,6-dichlorophenyl)methylideneamino]thiourea
| Molecular Formula | C8H7Cl2N3S |
|---|---|
| Molecular Weight | 246.97 g/mol |
| LogP | 2.1605 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.97377 |
| Heavy Atoms | 14 |
| Complexity | 358.59918 |
Chemical Identifiers
| CAS Number | 88141-27-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)/C=N/NC(=S)N)Cl |
Product Overview
2,6-Dichlorobenzaldehyde thiosemicarbazone (CAS 88141-27-9), with molecular formula C8H7Cl2N3S and molecular weight 246.97 g/mol. IUPAC: [(E)-(2,6-dichlorophenyl)methylideneamino]thiourea.
Chemical Property Profile of 2,6-Dichlorobenzaldehyde thiosemicarbazone
Property Insights of 2,6-Dichlorobenzaldehyde thiosemicarbazone
The XLogP value of 2.1605 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dichlorobenzaldehyde thiosemicarbazone. With a topological polar surface area (TPSA) of 50.41 Ų, 2,6-Dichlorobenzaldehyde thiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichlorobenzaldehyde thiosemicarbazone 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 2,6-Dichlorobenzaldehyde thiosemicarbazone?
The CAS number of 2,6-Dichlorobenzaldehyde thiosemicarbazone is 88141-27-9.
What is the molecular formula of 2,6-Dichlorobenzaldehyde thiosemicarbazone?
The molecular formula of 2,6-Dichlorobenzaldehyde thiosemicarbazone is C8H7Cl2N3S.
What is the molecular weight of 2,6-Dichlorobenzaldehyde thiosemicarbazone?
The molecular weight of 2,6-Dichlorobenzaldehyde thiosemicarbazone is 246.97 g/mol.
Where can I buy 2,6-Dichlorobenzaldehyde thiosemicarbazone?
You can request a quote for 2,6-Dichlorobenzaldehyde thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dichlorobenzaldehyde thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dichlorobenzaldehyde thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.