t-Butyloxycarbonyl-phenylalanyl-prolinal
TL;DR: t-Butyloxycarbonyl-phenylalanyl-prolinal (CAS 99952-46-2) is a chemical compound with molecular formula C19H26N2O4 and molecular weight 346.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[(2S)-1-[(2S)-2-formylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate
Also Known As: t-Butyloxycarbonyl-phenylalanyl-prolinal, Carbamic acid, (2-(2-formyl-1-pyrrolidinyl)-2-oxo-1-(phenylmethyl)ethyl)-, 1,1-dimethylethyl ester, (S-(R*,R*))-, tert-Butyl {(2S)-1-[(2S)-2-formylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate, tert-butyl N-[(2S)-1-[(2S)-2-formylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate, RefChem:331841
| Molecular Formula | C19H26N2O4 |
|---|---|
| Molecular Weight | 346.19 g/mol |
| LogP | 2.3123 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.18927 |
| Heavy Atoms | 25 |
| Complexity | 609.60016 |
Chemical Identifiers
| CAS Number | 99952-46-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C=O |
Product Overview
t-Butyloxycarbonyl-phenylalanyl-prolinal (CAS 99952-46-2), with molecular formula C19H26N2O4 and molecular weight 346.19 g/mol. IUPAC: tert-butyl N-[(2S)-1-[(2S)-2-formylpyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate.
Chemical Property Profile of t-Butyloxycarbonyl-phenylalanyl-prolinal
Property Insights of t-Butyloxycarbonyl-phenylalanyl-prolinal
The XLogP value of 2.3123 suggests moderate lipophilicity, balancing water solubility and membrane permeability for t-Butyloxycarbonyl-phenylalanyl-prolinal. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for t-Butyloxycarbonyl-phenylalanyl-prolinal. Following Lipinski's Rule of Five, t-Butyloxycarbonyl-phenylalanyl-prolinal 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 t-Butyloxycarbonyl-phenylalanyl-prolinal?
The CAS number of t-Butyloxycarbonyl-phenylalanyl-prolinal is 99952-46-2.
What is the molecular formula of t-Butyloxycarbonyl-phenylalanyl-prolinal?
The molecular formula of t-Butyloxycarbonyl-phenylalanyl-prolinal is C19H26N2O4.
What is the molecular weight of t-Butyloxycarbonyl-phenylalanyl-prolinal?
The molecular weight of t-Butyloxycarbonyl-phenylalanyl-prolinal is 346.19 g/mol.
Where can I buy t-Butyloxycarbonyl-phenylalanyl-prolinal?
You can request a quote for t-Butyloxycarbonyl-phenylalanyl-prolinal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for t-Butyloxycarbonyl-phenylalanyl-prolinal?
Yes, KEHONG BIO provides custom synthesis services for t-Butyloxycarbonyl-phenylalanyl-prolinal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.