2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole
TL;DR: 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole (CAS 54648-86-1) is a chemical compound with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methoxyphenyl)-3-[[2-(2-methyl-1H-indol-3-yl)acetyl]amino]thiourea
Also Known As: 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole, 1H-Indole-3-acetic acid, 2-methyl-, 2-(((2-methoxyphenyl)amino)thioxomethyl)hydrazide, 2-Methyl-1H-indole-3-acetic acid 2-(((2-methoxyphenyl)amino)thioxomethyl)hydrazide, 1-(2-methoxyphenyl)-3-[[2-(2-methyl-1H-indol-3-yl)acetyl]amino]thiourea, N-(2-Methoxyphenyl)-2-[(2-methyl-1H-indol-3-yl)acetyl]hydrazine-1-carbothioamide
| Molecular Formula | C19H20N4O2S |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 3.04522 |
| Topological Polar Surface Area | 78.18 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.1307 |
| Heavy Atoms | 26 |
| Complexity | 951.61707 |
Chemical Identifiers
| CAS Number | 54648-86-1 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)CC(=O)NNC(=S)NC3=CC=CC=C3OC |
Product Overview
2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole (CAS 54648-86-1), with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol. IUPAC: 1-(2-methoxyphenyl)-3-[[2-(2-methyl-1H-indol-3-yl)acetyl]amino]thiourea.
Chemical Property Profile of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole
Property Insights of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole
The XLogP value of 3.04522 indicates that 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole. Following Lipinski's Rule of Five, 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole has 4 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 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole?
The CAS number of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole is 54648-86-1.
What is the molecular formula of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole?
The molecular formula of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole is C19H20N4O2S.
What is the molecular weight of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole?
The molecular weight of 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole is 368.13 g/mol.
Where can I buy 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole?
You can request a quote for 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-(1-(4-o-anisylthiocarbazido))acetylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.