![methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate structure](/static/products/956/956041-85-3.png)
methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate
TL;DR: methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate (CAS 956041-85-3) is a chemical compound with molecular formula C15H19N3O3 and molecular weight 289.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[2-(1H-indol-3-yl)ethylcarbamoylamino]propanoate
Also Known As: methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate, (S)-methyl 2-(3-(2-(1H-indol-3-yl)ethyl)ureido)propanoate, methyl (2S)-2-[2-(1H-indol-3-yl)ethylcarbamoylamino]propanoate
| Molecular Formula | C15H19N3O3 |
|---|---|
| Molecular Weight | 289.14 g/mol |
| LogP | 1.5711 |
| Topological Polar Surface Area | 83.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.14264 |
| Heavy Atoms | 21 |
| Complexity | 635.8805 |
Chemical Identifiers
| CAS Number | 956041-85-3 |
|---|---|
| SMILES | C[C@@H](C(=O)OC)NC(=O)NCCC1=CNC2=CC=CC=C21 |
Product Overview
methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate (CAS 956041-85-3), with molecular formula C15H19N3O3 and molecular weight 289.14 g/mol. IUPAC: methyl (2S)-2-[2-(1H-indol-3-yl)ethylcarbamoylamino]propanoate.
Chemical Property Profile of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate
Property Insights of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate
The XLogP value of 1.5711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate. The TPSA of 83.22 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate. Following Lipinski's Rule of Five, methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate has 3 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 methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate?
The CAS number of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate is 956041-85-3.
What is the molecular formula of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate?
The molecular formula of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate is C15H19N3O3.
What is the molecular weight of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate?
The molecular weight of methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate is 289.14 g/mol.
Where can I buy methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate?
You can request a quote for methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-{[2-(1H-indol-3-yl)ethyl]carbamoyl}-L-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.