tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate
TL;DR: tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate (CAS 6035-58-1) is a chemical compound with molecular formula C17H22N2O3 and molecular weight 302.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate
Also Known As: rhamnose-phenylhydrazone, Fucose, phenylhydrazone, D-, D-Galactose, 6-deoxy-, phenylhydrazone(9CI), D-Galactose, 6-deoxy-, phenylhydrazone, D-Galactose,6-deoxy-,phenylhydrazone(9ci)
| Molecular Formula | C17H22N2O3 |
|---|---|
| Molecular Weight | 302.16 g/mol |
| LogP | 3.0463 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.16306 |
| Heavy Atoms | 22 |
| Complexity | 573.3169 |
Chemical Identifiers
| CAS Number | 6035-58-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NNC1=CC(=O)CC(C1)C2=CC=CC=C2 |
Product Overview
tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate (CAS 6035-58-1), with molecular formula C17H22N2O3 and molecular weight 302.16 g/mol. IUPAC: tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate.
Chemical Property Profile of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate
Property Insights of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate
The XLogP value of 3.0463 indicates that tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate 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 tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate?
The CAS number of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate is 6035-58-1.
What is the molecular formula of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate?
The molecular formula of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate is C17H22N2O3.
What is the molecular weight of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate?
The molecular weight of tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate is 302.16 g/mol.
Where can I buy tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate?
You can request a quote for tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[(3-oxo-5-phenylcyclohexen-1-yl)amino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.