Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate
TL;DR: Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate (CAS 114744-83-1) is a chemical compound with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[1-[methoxy(methyl)amino]-1-oxopropan-2-yl]carbamate
Also Known As: Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate, benzyl N-[1-[methoxy(methyl)amino]-1-oxopropan-2-yl]carbamate, benzyl N-{1-[methoxy(methyl)carbamoyl]ethyl}carbamate, NCI60_019226, 2-(Cbz-amino)-N-methoxy-N-methylpropanamide
| Molecular Formula | C13H18N2O4 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 266.12665 |
| Heavy Atoms | 19 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 114744-83-1 |
|---|---|
| SMILES | CC(C(=O)N(C)OC)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | JJWLCBIYQXRMNO-UHFFFAOYSA-N |
Product Overview
Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate (CAS 114744-83-1), with molecular formula C13H18N2O4 and molecular weight 266.13 g/mol. IUPAC: benzyl N-[1-[methoxy(methyl)amino]-1-oxopropan-2-yl]carbamate.
Chemical Property Profile of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate
Property Insights of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate. Following Lipinski's Rule of Five, Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate 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 Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate?
The CAS number of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate is 114744-83-1.
What is the molecular formula of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate?
The molecular formula of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate is C13H18N2O4.
What is the molecular weight of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate?
The molecular weight of Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate is 266.13 g/mol.
Where can I buy Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate?
You can request a quote for Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl (1-(methoxy(methyl)amino)-1-oxopropan-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.