Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate
TL;DR: Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate (CAS 701276-55-3) is a chemical compound with molecular formula C12H15F2N3O3 and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2,4-difluorophenyl)carbamoylamino]carbamate
Also Known As: tert-butyl N-[(2,4-difluorophenyl)carbamoylamino]carbamate, tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate, tert-butyl 2-[(2,4-difluorophenyl)carbamoyl]hydrazinecarboxylate, N-{[(2,4-difluorophenyl)amino]carbonylamino}(tert-butoxy)carboxamide
| Molecular Formula | C12H15F2N3O3 |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 2.526 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 287.10815 |
| Heavy Atoms | 20 |
| Complexity | 515.1593 |
Chemical Identifiers
| CAS Number | 701276-55-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NNC(=O)NC1=C(C=C(C=C1)F)F |
Product Overview
Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate (CAS 701276-55-3), with molecular formula C12H15F2N3O3 and molecular weight 287.11 g/mol. IUPAC: tert-butyl N-[(2,4-difluorophenyl)carbamoylamino]carbamate.
Chemical Property Profile of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate
Property Insights of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate
The XLogP value of 2.526 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate. Following Lipinski's Rule of Five, Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate has 3 hydrogen bond donor(s) and 3 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 Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate?
The CAS number of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate is 701276-55-3.
What is the molecular formula of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate?
The molecular formula of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate is C12H15F2N3O3.
What is the molecular weight of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate?
The molecular weight of Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate is 287.11 g/mol.
Where can I buy Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate?
You can request a quote for Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 2-((2,4-difluorophenyl)carbamoyl)hydrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.