2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide
TL;DR: 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide (CAS 54992-19-7) is a chemical compound with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]acetamide
Also Known As: Neurotoxin alpha, 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide, 2-Chloro-N-((2,3-dimethyl-1H-indol-5-yl)methyl)acetamide, 2-chloro-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]acetamide, BAS 02646167
| Molecular Formula | C13H15ClN2O |
|---|---|
| Molecular Weight | 250.09 g/mol |
| LogP | 2.63974 |
| Topological Polar Surface Area | 44.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.0873 |
| Heavy Atoms | 17 |
| Complexity | 559.79 |
Chemical Identifiers
| CAS Number | 54992-19-7 |
|---|---|
| SMILES | CC1=C(NC2=C1C=C(C=C2)CNC(=O)CCl)C |
Product Overview
2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide (CAS 54992-19-7), with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol. IUPAC: 2-chloro-N-[(2,3-dimethyl-1H-indol-5-yl)methyl]acetamide.
Chemical Property Profile of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide
Property Insights of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide
The XLogP value of 2.63974 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide. With a topological polar surface area (TPSA) of 44.89 Ų, 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide has 2 hydrogen bond donor(s) and 1 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-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide?
The CAS number of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide is 54992-19-7.
What is the molecular formula of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide?
The molecular formula of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide is C13H15ClN2O.
What is the molecular weight of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide?
The molecular weight of 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide is 250.09 g/mol.
Where can I buy 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide?
You can request a quote for 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-N-(2,3-dimethyl-1H-indol-5-ylmethyl)-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.