(S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate
TL;DR: (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate (CAS 16874-09-2) is a chemical compound with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate
Also Known As: H-Trp-OtBu, H-TRP-OTBU HCL, L-Trp-OtBu HCl, H-Trp-OtBu . HCl, tert-Butyl L-tryptophanate
| Molecular Formula | C15H20N2O2 |
|---|---|
| Molecular Weight | 260.15 g/mol |
| LogP | 2.3794 |
| Topological Polar Surface Area | 68.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.15247 |
| Heavy Atoms | 19 |
| Complexity | 581.08826 |
Chemical Identifiers
| CAS Number | 16874-09-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@H](CC1=CNC2=CC=CC=C21)N |
Product Overview
(S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate (CAS 16874-09-2), with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol. IUPAC: tert-butyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate.
Chemical Property Profile of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate
Property Insights of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate
The XLogP value of 2.3794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate. The TPSA of 68.11 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate. Following Lipinski's Rule of Five, (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate 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 (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate?
The CAS number of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate is 16874-09-2.
What is the molecular formula of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate?
The molecular formula of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate is C15H20N2O2.
What is the molecular weight of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate?
The molecular weight of (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate is 260.15 g/mol.
Where can I buy (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate?
You can request a quote for (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-tert-Butyl 2-amino-3-(1H-indol-3-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.