![1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea structure](/static/products/1022/1022401-73-5.webp)
1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea
TL;DR: 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea (CAS 1022401-73-5) is a chemical compound with molecular formula C18H18N4OS and molecular weight 338.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea
Also Known As: 1-(2-(INDOL-3-YL)ACETYL)-4-BENZYLTHIOSEMICARBAZIDE, 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea, N-[(benzylcarbamothioyl)amino]-2-(1H-indol-3-yl)acetamide, 2-(2-(1H-Indol-3-yl)acetyl)-N-benzylhydrazine-1-carbothioamide
Technical Specifications
| Molecular Formula | C18H18N4OS |
| Molecular Weight | 338.12012 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.12012 Da |
| Heavy Atoms | 24 |
| Complexity | 439.0 |
| SMILES | C1=CC=C(C=C1)CNC(=S)NNC(=O)CC2=CNC3=CC=CC=C32 |
| InChIKey | URPOBMRIFAVHMB-UHFFFAOYSA-N |
Chemical Property Profile of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea
Property Insights of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea. Following Lipinski's Rule of Five, 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea has 4 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea?
The CAS number of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea is 1022401-73-5.
What is the molecular formula of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea?
The molecular formula of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea is C18H18N4OS.
What is the molecular weight of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea?
The molecular weight of 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea is 338.12012 g/mol.
Where can I buy 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea?
You can request a quote for 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea?
Yes, CoreyChem provides custom synthesis services for 1-benzyl-3-[[2-(1H-indol-3-yl)acetyl]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.