Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate
TL;DR: Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate (CAS 675602-76-3) is a chemical compound with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl)-N-methylcarbamate
Also Known As: (S)-1-Pyrrolidin-2-hydroxymethyll-2-(N-Cbz-N-Methyl)amino-ethane, (S)-Benzyl (1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate, Benzyl N-(1-hydroxy-3-pyrrolidin-1-yl-propan-2-yl)-N-methyl-carbamate, benzyl N-(1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl)-N-methylcarbamate, benzyl N-[(2S)-1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl]-N-methylcarbamate
| Molecular Formula | C16H24N2O3 |
|---|---|
| Molecular Weight | 292.18 g/mol |
| LogP | 1.7117 |
| Topological Polar Surface Area | 53.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.17868 |
| Heavy Atoms | 21 |
| Complexity | 432.40805 |
Chemical Identifiers
| CAS Number | 675602-76-3 |
|---|---|
| SMILES | CN(C(CN1CCCC1)CO)C(=O)OCC2=CC=CC=C2 |
Product Overview
Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate (CAS 675602-76-3), with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol. IUPAC: benzyl N-(1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl)-N-methylcarbamate.
Chemical Property Profile of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate
Property Insights of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate
The XLogP value of 1.7117 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate. With a topological polar surface area (TPSA) of 53.01 Ų, Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)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(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate?
The CAS number of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate is 675602-76-3.
What is the molecular formula of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate?
The molecular formula of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate is C16H24N2O3.
What is the molecular weight of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate?
The molecular weight of Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate is 292.18 g/mol.
Where can I buy Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate?
You can request a quote for Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl(S)-(1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl)(methyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.