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[(2,3,6-Trichlorophenyl)methylideneamino]thiourea
TL;DR: [(2,3,6-Trichlorophenyl)methylideneamino]thiourea (CAS 316159-21-4) is a chemical compound with molecular formula C8H6Cl3N3S and molecular weight 280.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2,3,6-trichlorophenyl)methylideneamino]thiourea
Also Known As: [(2,3,6-trichlorophenyl)methylideneamino]thiourea|N'-(2,3,6-trichlorobenzylidene)carbamohydrazonothioic acid
| Molecular Formula | C8H6Cl3N3S |
|---|---|
| Molecular Weight | 280.93 g/mol |
| LogP | 2.8139 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.9348 |
| Heavy Atoms | 15 |
| Complexity | 419.83807 |
Chemical Identifiers
| CAS Number | 316159-21-4 |
|---|---|
| SMILES | C1=CC(=C(C(=C1Cl)C=NNC(=S)N)Cl)Cl |
Product Overview
[(2,3,6-Trichlorophenyl)methylideneamino]thiourea (CAS 316159-21-4), with molecular formula C8H6Cl3N3S and molecular weight 280.93 g/mol. IUPAC: [(2,3,6-trichlorophenyl)methylideneamino]thiourea.
Chemical Property Profile of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea
Property Insights of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea
The XLogP value of 2.8139 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2,3,6-Trichlorophenyl)methylideneamino]thiourea. With a topological polar surface area (TPSA) of 50.41 Ų, [(2,3,6-Trichlorophenyl)methylideneamino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2,3,6-Trichlorophenyl)methylideneamino]thiourea 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 [(2,3,6-Trichlorophenyl)methylideneamino]thiourea?
The CAS number of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea is 316159-21-4.
What is the molecular formula of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea?
The molecular formula of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea is C8H6Cl3N3S.
What is the molecular weight of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea?
The molecular weight of [(2,3,6-Trichlorophenyl)methylideneamino]thiourea is 280.93 g/mol.
Where can I buy [(2,3,6-Trichlorophenyl)methylideneamino]thiourea?
You can request a quote for [(2,3,6-Trichlorophenyl)methylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2,3,6-Trichlorophenyl)methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(2,3,6-Trichlorophenyl)methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.