tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate
TL;DR: tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate (CAS 129095-62-1) is a chemical compound with molecular formula C14H20N2O3 and molecular weight 264.15 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-phenylpropan-2-yl)carbamate
Also Known As: Boc-L-phenylalaninamide, Trimethylarsineoxide, tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate, N-(tert-Butoxycarbonyl)phenylalanine amide, 3-Phenylpropanamide, 2-t-butoxycarbonylamino-
| Molecular Formula | C14H20N2O3 |
|---|---|
| Molecular Weight | 264.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.1474 |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 129095-62-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N |
| InChIKey | DHUPSFPAFRFQRO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate (CAS 129095-62-1), with molecular formula C14H20N2O3 and molecular weight 264.15 g/mol. IUPAC: tert-butyl N-(1-amino-1-oxo-3-phenylpropan-2-yl)carbamate.
Chemical Property Profile of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate
Property Insights of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate. Following Lipinski's Rule of Five, tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate has 2 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 N-(1-carbamoyl-2-phenylethyl)carbamate?
The CAS number of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate is 129095-62-1.
What is the molecular formula of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate?
The molecular formula of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate is C14H20N2O3.
What is the molecular weight of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate?
The molecular weight of tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate is 264.15 g/mol.
Where can I buy tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate?
You can request a quote for tert-butyl N-(1-carbamoyl-2-phenylethyl)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-(1-carbamoyl-2-phenylethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-(1-carbamoyl-2-phenylethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.