tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate
TL;DR: tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate (CAS 331627-28-2) is a chemical compound with molecular formula C16H24N2O4 and molecular weight 308.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(1-amino-1-oxo-3-phenylmethoxybutan-2-yl)carbamate
Also Known As: tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate, Maybridge1_004374, JFD 03350, tert-butyl N-(1-amino-1-oxo-3-phenylmethoxybutan-2-yl)carbamate, BRD-A95271682-001-01-3
| Molecular Formula | C16H24N2O4 |
|---|---|
| Molecular Weight | 308.17 g/mol |
| LogP | 1.9703 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.1736 |
| Heavy Atoms | 22 |
| Complexity | 496.6173 |
Chemical Identifiers
| CAS Number | 331627-28-2 |
|---|---|
| SMILES | CC(C(C(=O)N)NC(=O)OC(C)(C)C)OCC1=CC=CC=C1 |
Product Overview
tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate (CAS 331627-28-2), with molecular formula C16H24N2O4 and molecular weight 308.17 g/mol. IUPAC: tert-butyl N-(1-amino-1-oxo-3-phenylmethoxybutan-2-yl)carbamate.
Chemical Property Profile of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate
Property Insights of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate
The XLogP value of 1.9703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]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-[2-(benzyloxy)-1-carbamoylpropyl]carbamate?
The CAS number of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate is 331627-28-2.
What is the molecular formula of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate?
The molecular formula of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate is C16H24N2O4.
What is the molecular weight of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate?
The molecular weight of tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate is 308.17 g/mol.
Where can I buy tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate?
You can request a quote for tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]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-[2-(benzyloxy)-1-carbamoylpropyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[2-(benzyloxy)-1-carbamoylpropyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.