methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate
TL;DR: methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate (CAS 5457-81-8) is a chemical compound with molecular formula C7H13N3O3 and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(carbamoylhydrazinylidene)pentanoate
Also Known As: Octanoic acid,cyclopentyl ester, methyl 4-(carbamoylhydrazinylidene)pentanoate, methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate, methyl 4-(2-carbamoylhydrazinylidene)pentanoate
| Molecular Formula | C7H13N3O3 |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.09569 |
| Heavy Atoms | 13 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 5457-81-8 |
|---|---|
| SMILES | CC(=NNC(=O)N)CCC(=O)OC |
| InChIKey | DLPCAZQAWXZGFM-UHFFFAOYSA-N |
Product Overview
methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate (CAS 5457-81-8), with molecular formula C7H13N3O3 and molecular weight 187.10 g/mol. IUPAC: methyl 4-(carbamoylhydrazinylidene)pentanoate.
Chemical Property Profile of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate
Property Insights of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate
The XLogP value of -1.1 indicates that methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate. Following Lipinski's Rule of Five, methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate 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
Frequently Asked Questions
What is the CAS number of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate?
The CAS number of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate is 5457-81-8.
What is the molecular formula of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate?
The molecular formula of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate is C7H13N3O3.
What is the molecular weight of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate?
The molecular weight of methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate is 187.10 g/mol.
Where can I buy methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate?
You can request a quote for methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.