![methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate structure](/static/products/139/1396774-37-0.webp)
methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate
TL;DR: methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate (CAS 1396774-37-0) is a chemical compound with molecular formula C10H11N3O3 and molecular weight 221.08005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate
Also Known As: J3.176.957D, 4-(Semicarbazonomethyl)benzoic acid methyl ester, methyl 4-[(E)-[(carbamoylamino)imino]methyl]benzoate, methyl 4-{[(carbamoylamino)imino]methyl}benzoate, methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate
Technical Specifications
| Molecular Formula | C10H11N3O3 |
| Molecular Weight | 221.08005 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.08005 Da |
| Heavy Atoms | 16 |
| Complexity | 283.0 |
| SMILES | COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)N |
| InChIKey | JZYWSTUUZDYVMM-WUXMJOGZSA-N |
Chemical Property Profile of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate
Property Insights of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate. Following Lipinski's Rule of Five, methyl 4-[(E)-(carbamoylhydrazinylidene)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-[(E)-(carbamoylhydrazinylidene)methyl]benzoate?
The CAS number of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate is 1396774-37-0.
What is the molecular formula of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate?
The molecular formula of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate is C10H11N3O3.
What is the molecular weight of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate?
The molecular weight of methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate is 221.08005 g/mol.
Where can I buy methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate?
You can request a quote for methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate?
Yes, CoreyChem provides custom synthesis services for methyl 4-[(E)-(carbamoylhydrazinylidene)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.