Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester
TL;DR: Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester (CAS 50722-42-4) is a chemical compound with molecular formula C15H22N2O3 and molecular weight 278.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[1-(butylamino)-1-oxopropan-2-yl]carbamate
Also Known As: N-Cbz-L-alanine Butylamide, Benzyl N-[(1S)-1-(butylcarbamoyl)ethyl]carbamate, Benzyl 2-(butylamino)-1-methyl-2-oxoethylcarbamate #, benzyl N-[1-(butylamino)-1-oxopropan-2-yl]carbamate, Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester
| Molecular Formula | C15H22N2O3 |
|---|---|
| Molecular Weight | 278.16 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.16306 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 50722-42-4 |
|---|---|
| SMILES | CCCCNC(=O)C(C)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | RCMRNDJPAVGSRO-UHFFFAOYSA-N |
Product Overview
Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester (CAS 50722-42-4), with molecular formula C15H22N2O3 and molecular weight 278.16 g/mol. IUPAC: benzyl N-[1-(butylamino)-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester
Property Insights of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester. Following Lipinski's Rule of Five, Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester 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 Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester?
The CAS number of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester is 50722-42-4.
What is the molecular formula of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester?
The molecular formula of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester is C15H22N2O3.
What is the molecular weight of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester?
The molecular weight of Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester is 278.16 g/mol.
Where can I buy Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester?
You can request a quote for Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acaid, N-(1-butylaminocarbonyl)ethyl-, benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.