Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide
TL;DR: Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide (CAS 54753-63-8) is a chemical compound with molecular formula C20H21N3O2S and molecular weight 367.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-3-benzylsulfanyl-3-(1H-indol-3-yl)propanamide
Also Known As: ChemDiv2_000778, BAS 02078329, Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide, 2-acetamido-3-(benzylthio)-3-(1H-indol-3-yl)propanamide, 2-acetamido-3-benzylsulfanyl-3-(1H-indol-3-yl)propanamide
| Molecular Formula | C20H21N3O2S |
|---|---|
| Molecular Weight | 367.14 g/mol |
| LogP | 3.1324 |
| Topological Polar Surface Area | 87.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.13544 |
| Heavy Atoms | 26 |
| Complexity | 907.575 |
Chemical Identifiers
| CAS Number | 54753-63-8 |
|---|---|
| SMILES | CC(=O)NC(C(C1=CNC2=CC=CC=C21)SCC3=CC=CC=C3)C(=O)N |
Product Overview
Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide (CAS 54753-63-8), with molecular formula C20H21N3O2S and molecular weight 367.14 g/mol. IUPAC: 2-acetamido-3-benzylsulfanyl-3-(1H-indol-3-yl)propanamide.
Chemical Property Profile of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide
Property Insights of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide
The XLogP value of 3.1324 indicates that Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.98 Ų falls within the moderate polarity range, balancing permeability and solubility for Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide. Following Lipinski's Rule of Five, Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide 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 Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide?
The CAS number of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide is 54753-63-8.
What is the molecular formula of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide?
The molecular formula of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide is C20H21N3O2S.
What is the molecular weight of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide?
The molecular weight of Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide is 367.14 g/mol.
Where can I buy Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide?
You can request a quote for Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide?
Yes, KEHONG BIO provides custom synthesis services for Nalpha-acetyl-beta-(benzylsulfanyl)tryptophanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.