Tert-butyl pyridazin-3-ylcarbamate
TL;DR: Tert-butyl pyridazin-3-ylcarbamate (CAS 147362-90-1) is a chemical compound with molecular formula C9H13N3O2 and molecular weight 195.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-pyridazin-3-ylcarbamate
Also Known As: tert-butyl pyridazin-3-ylcarbamate, tert-butyl N-pyridazin-3-ylcarbamate, 3-(t-butoxycarbonylamino)pyridazine, TERT-BUTYL N-(PYRIDAZIN-3-YL)CARBAMATE, 1,1-Dimethylethyl 3-pyridazinylcarbamate
| Molecular Formula | C9H13N3O2 |
|---|---|
| Molecular Weight | 195.10 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.10077 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 147362-90-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=NN=CC=C1 |
| InChIKey | KLWNKSCHTFDBEJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tert-butyl pyridazin-3-ylcarbamate (CAS 147362-90-1), with molecular formula C9H13N3O2 and molecular weight 195.10 g/mol. IUPAC: tert-butyl N-pyridazin-3-ylcarbamate.
Chemical Property Profile of Tert-butyl pyridazin-3-ylcarbamate
Property Insights of Tert-butyl pyridazin-3-ylcarbamate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl pyridazin-3-ylcarbamate. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl pyridazin-3-ylcarbamate. Following Lipinski's Rule of Five, Tert-butyl pyridazin-3-ylcarbamate has 1 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 Tert-butyl pyridazin-3-ylcarbamate?
The CAS number of Tert-butyl pyridazin-3-ylcarbamate is 147362-90-1.
What is the molecular formula of Tert-butyl pyridazin-3-ylcarbamate?
The molecular formula of Tert-butyl pyridazin-3-ylcarbamate is C9H13N3O2.
What is the molecular weight of Tert-butyl pyridazin-3-ylcarbamate?
The molecular weight of Tert-butyl pyridazin-3-ylcarbamate is 195.10 g/mol.
Where can I buy Tert-butyl pyridazin-3-ylcarbamate?
You can request a quote for Tert-butyl pyridazin-3-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl pyridazin-3-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl pyridazin-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.