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[(2-Methylphenyl)methylideneamino]thiourea
TL;DR: [(2-Methylphenyl)methylideneamino]thiourea (CAS 5706-81-0) is a chemical compound with molecular formula C9H11N3S and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-methylphenyl)methylideneamino]thiourea
Also Known As: [(2-methylphenyl)methylideneamino]thiourea|2-Methyl-benzaldehyd-thiosemicarbazon|Hydrazinecarbothioamide, 2-[(2-methylphenyl)methylene]-|2-[(2-Methylphenyl)methylidene]hydrazine-1-carbothioamide
| Molecular Formula | C9H11N3S |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.06737 |
| Heavy Atoms | 13 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 5706-81-0 |
|---|---|
| SMILES | CC1=CC=CC=C1C=NNC(=S)N |
| InChIKey | HFJJVDKBEWNQLV-UHFFFAOYSA-N |
Product Overview
[(2-Methylphenyl)methylideneamino]thiourea (CAS 5706-81-0), with molecular formula C9H11N3S and molecular weight 193.07 g/mol. IUPAC: [(2-methylphenyl)methylideneamino]thiourea.
Chemical Property Profile of [(2-Methylphenyl)methylideneamino]thiourea
Property Insights of [(2-Methylphenyl)methylideneamino]thiourea
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Methylphenyl)methylideneamino]thiourea. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-Methylphenyl)methylideneamino]thiourea. Following Lipinski's Rule of Five, [(2-Methylphenyl)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-Methylphenyl)methylideneamino]thiourea?
The CAS number of [(2-Methylphenyl)methylideneamino]thiourea is 5706-81-0.
What is the molecular formula of [(2-Methylphenyl)methylideneamino]thiourea?
The molecular formula of [(2-Methylphenyl)methylideneamino]thiourea is C9H11N3S.
What is the molecular weight of [(2-Methylphenyl)methylideneamino]thiourea?
The molecular weight of [(2-Methylphenyl)methylideneamino]thiourea is 193.07 g/mol.
Where can I buy [(2-Methylphenyl)methylideneamino]thiourea?
You can request a quote for [(2-Methylphenyl)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-Methylphenyl)methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(2-Methylphenyl)methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.