Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate
TL;DR: Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate (CAS 5472-97-9) is a chemical compound with molecular formula C9H15N3O5 and molecular weight 245.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-(carbamoylhydrazinylidene)hexanedioate
Also Known As: dimethyl 3-(carbamoylhydrazinylidene)hexanedioate, dimethyl 3-(2-carbamoylhydrazinylidene)hexanedioate, dimethyl (3Z)-3-(carbamoylhydrazinylidene)hexanedioate
| Molecular Formula | C9H15N3O5 |
|---|---|
| Molecular Weight | 245.10 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 245.10117 |
| Heavy Atoms | 17 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 5472-97-9 |
|---|---|
| SMILES | COC(=O)CCC(=NNC(=O)N)CC(=O)OC |
| InChIKey | DQQMXKTXGMNYQY-UHFFFAOYSA-N |
Product Overview
Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate (CAS 5472-97-9), with molecular formula C9H15N3O5 and molecular weight 245.10 g/mol. IUPAC: dimethyl 3-(carbamoylhydrazinylidene)hexanedioate.
Chemical Property Profile of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate
Property Insights of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate
The XLogP value of -1.1 indicates that Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate. Following Lipinski's Rule of Five, Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate has 2 hydrogen bond donor(s) and 6 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 Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate?
The CAS number of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate is 5472-97-9.
What is the molecular formula of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate?
The molecular formula of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate is C9H15N3O5.
What is the molecular weight of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate?
The molecular weight of Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate is 245.10 g/mol.
Where can I buy Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate?
You can request a quote for Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3-(carbamoylhydrazinylidene)hexanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.