methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate
TL;DR: methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate (CAS 879477-01-7) is a chemical compound with molecular formula C25H30N4O4 and molecular weight 450.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]acetyl]amino]-1,5-dimethylindole-2-carboxylate
Also Known As: methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate, methyl 3-(2-(4-(2-methoxyphenyl)piperazin-1-yl)acetamido)-1,5-dimethyl-1H-indole-2-carboxylate, methyl 3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]acetyl]amino]-1,5-dimethylindole-2-carboxylate
| Molecular Formula | C25H30N4O4 |
|---|---|
| Molecular Weight | 450.23 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.2267 |
| Heavy Atoms | 33 |
| Complexity | 683.0 |
Chemical Identifiers
| CAS Number | 879477-01-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=C2NC(=O)CN3CCN(CC3)C4=CC=CC=C4OC)C(=O)OC)C |
| InChIKey | VXELVRHJEORZGM-UHFFFAOYSA-N |
Product Overview
methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate (CAS 879477-01-7), with molecular formula C25H30N4O4 and molecular weight 450.23 g/mol. IUPAC: methyl 3-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]acetyl]amino]-1,5-dimethylindole-2-carboxylate.
Chemical Property Profile of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate
Property Insights of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate
The XLogP value of 3.9 indicates that methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate has 1 hydrogen bond donor(s) and 6 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 methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate?
The CAS number of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate is 879477-01-7.
What is the molecular formula of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate?
The molecular formula of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate is C25H30N4O4.
What is the molecular weight of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate?
The molecular weight of methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate is 450.23 g/mol.
Where can I buy methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate?
You can request a quote for methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1,5-dimethyl-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.