2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide
TL;DR: 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide (CAS 136039-38-8) is a chemical compound with molecular formula C11H12ClN3O and molecular weight 237.0669 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide
Also Known As: 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide, 2-chloro-N-(3-cyano(4,5,6,7-tetrahydroindol-2-yl))acetamide, 2-(Chloroacetylamino)-4,5,6,7-tetrahydro-1H-indole-3-carbonitrile
Technical Specifications
| Molecular Formula | C11H12ClN3O |
| Molecular Weight | 237.0669 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 68.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.0669 Da |
| Heavy Atoms | 16 |
| Complexity | 324.0 |
| SMILES | C1CCC2=C(C1)C(=C(N2)NC(=O)CCl)C#N |
| InChIKey | LBCVJIMZUADLGQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide
Property Insights of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide. The TPSA of 68.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide. Following Lipinski's Rule of Five, 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide has 2 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 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide?
The CAS number of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide is 136039-38-8.
What is the molecular formula of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide?
The molecular formula of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide is C11H12ClN3O.
What is the molecular weight of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide?
The molecular weight of 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide is 237.0669 g/mol.
Where can I buy 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide?
You can request a quote for 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1H-indol-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.