Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride
TL;DR: Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride (CAS 35891-42-0) is a chemical compound with molecular formula C19H21ClN2OS and molecular weight 360.10632 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(1-acetylindol-3-yl)-2-benzylsulfanylethyl]azanium chloride
Also Known As: INDOLE, 1-ACETYL-3-(2-AMINO-1-BENZYLTHIOETHYL)-, HYDROCHLORIDE, 1-Benzylmercapto-1-(1'-acetyl-3'-indolyl)-2-aminoethane hydrochloride, [2-(1-acetylindol-3-yl)-2-benzylsulfanylethyl]azanium chloride
Technical Specifications
| Molecular Formula | C19H21ClN2OS |
| Molecular Weight | 360.10632 g/mol |
| XLogP | 0.52 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.10632 Da |
| Heavy Atoms | 24 |
| Complexity | 397.0 |
| SMILES | CC(=O)N1C=C(C2=CC=CC=C21)C(C[NH3+])SCC3=CC=CC=C3.[Cl-] |
| InChIKey | XQHXTHJJCBXZLB-UHFFFAOYSA-N |
Chemical Property Profile of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride
Property Insights of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride
The XLogP value of 0.52 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride. Following Lipinski's Rule of Five, Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride?
The CAS number of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride is 35891-42-0.
What is the molecular formula of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride?
The molecular formula of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride is C19H21ClN2OS.
What is the molecular weight of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride?
The molecular weight of Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride is 360.10632 g/mol.
Where can I buy Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride?
You can request a quote for Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Indole, 1-acetyl-3-(2-amino-1-benzylthioethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.