Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate
TL;DR: Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate (CAS 1024440-28-5) is a chemical compound with molecular formula C18H19N3O5 and molecular weight 357.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[2-oxo-2-[2-(phenylcarbamoyl)hydrazinyl]ethoxy]benzoate
Also Known As: ETHYL 3-((N-((PHENYLAMINO)CARBONYLAMINO)CARBAMOYL)METHOXY)BENZOATE, ethyl 3-[2-oxo-2-[2-(phenylcarbamoyl)hydrazinyl]ethoxy]benzoate, Ethyl 3-[(phenylcarbamoylamino)carbamoylmethoxy]benzoate, ethyl 3-({[(phenylcarbamoyl)amino]carbamoyl}methoxy)benzoate, ethyl 3-[2-oxo-2-[2-(phenylcarbamoyl)hydrazino]ethoxy]benzoate
| Molecular Formula | C18H19N3O5 |
|---|---|
| Molecular Weight | 357.13 g/mol |
| LogP | 2.095 |
| Topological Polar Surface Area | 105.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.13248 |
| Heavy Atoms | 26 |
| Complexity | 764.4317 |
Chemical Identifiers
| CAS Number | 1024440-28-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)OCC(=O)NNC(=O)NC2=CC=CC=C2 |
Product Overview
Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate (CAS 1024440-28-5), with molecular formula C18H19N3O5 and molecular weight 357.13 g/mol. IUPAC: ethyl 3-[2-oxo-2-[2-(phenylcarbamoyl)hydrazinyl]ethoxy]benzoate.
Chemical Property Profile of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate
Property Insights of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate
The XLogP value of 2.095 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate. The TPSA of 105.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate. Following Lipinski's Rule of Five, Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate has 3 hydrogen bond donor(s) and 5 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 Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate?
The CAS number of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate is 1024440-28-5.
What is the molecular formula of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate?
The molecular formula of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate is C18H19N3O5.
What is the molecular weight of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate?
The molecular weight of Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate is 357.13 g/mol.
Where can I buy Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate?
You can request a quote for Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-((N-((phenylamino)carbonylamino)carbamoyl)methoxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.