Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate
TL;DR: Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate (CAS 49705-98-8) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-1-amino-2-benzyl-3-hydroxy-1-oxobutan-2-yl] carbamate
Also Known As: Z-Thr-NH2, Z-L-threonine amide, EINECS 256-436-9, N-Benzyloxycarbonyl L-Threonine Amide, Z-Thr-NH2 - 25G 25g
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | -0.0707 |
| Topological Polar Surface Area | 115.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 432.96338 |
Chemical Identifiers
| CAS Number | 49705-98-8 |
|---|---|
| SMILES | C[C@@H]([C@](CC1=CC=CC=C1)(C(=O)N)OC(=O)N)O |
Product Overview
Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate (CAS 49705-98-8), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: [(2R,3S)-1-amino-2-benzyl-3-hydroxy-1-oxobutan-2-yl] carbamate.
Chemical Property Profile of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate
Property Insights of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate
The XLogP value of -0.0707 indicates that Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate. Following Lipinski's Rule of Five, Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate has 3 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 [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate?
The CAS number of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate is 49705-98-8.
What is the molecular formula of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate?
The molecular formula of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate is C12H16N2O4.
What is the molecular weight of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate?
The molecular weight of Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate is 252.11 g/mol.
Where can I buy Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate?
You can request a quote for Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl [R-(R*,S*)]-(1-carbamoyl-2-hydroxypropyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.