![Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate structure](/static/products/1100/110032-24-1.webp)
Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate
TL;DR: Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate (CAS 110032-24-1) is a chemical compound with molecular formula C10H11N3O2S and molecular weight 237.0572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate
Also Known As: Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate, 4-thiosemicarbazonomethyl-benzoic acid methyl ester
Technical Specifications
| Molecular Formula | C10H11N3O2S |
| Molecular Weight | 237.0572 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.0572 Da |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
| SMILES | COC(=O)C1=CC=C(C=C1)C=NNC(=S)N |
| InChIKey | RDLMTBKBBHRXDD-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate
Property Insights of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate. Following Lipinski's Rule of Five, Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate?
The CAS number of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate is 110032-24-1.
What is the molecular formula of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate?
The molecular formula of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate is C10H11N3O2S.
What is the molecular weight of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate?
The molecular weight of Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate is 237.0572 g/mol.
Where can I buy Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate?
You can request a quote for Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-[(carbamothioylhydrazinylidene)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.