methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate
TL;DR: methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate (CAS 848988-28-3) is a chemical compound with molecular formula C29H29ClN4O3 and molecular weight 516.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate
Also Known As: methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate, methyl 3-[({4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}acetyl)amino]-1H-indole-2-carboxylate, methyl 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate
| Molecular Formula | C29H29ClN4O3 |
|---|---|
| Molecular Weight | 516.19 g/mol |
| LogP | 4.9536 |
| Topological Polar Surface Area | 77.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 516.1928 |
| Heavy Atoms | 37 |
| Complexity | 1379.5663 |
Chemical Identifiers
| CAS Number | 848988-28-3 |
|---|---|
| SMILES | COC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl |
Product Overview
methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate (CAS 848988-28-3), with molecular formula C29H29ClN4O3 and molecular weight 516.19 g/mol. IUPAC: methyl 3-[[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate
Property Insights of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate
The XLogP value of 4.9536 indicates that methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.67 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
The CAS number of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is 848988-28-3.
What is the molecular formula of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
The molecular formula of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is C29H29ClN4O3.
What is the molecular weight of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
The molecular weight of methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate is 516.19 g/mol.
Where can I buy methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
You can request a quote for methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-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-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(2-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)acetamido)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.