methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride
TL;DR: methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride (CAS 1052533-56-8) is a chemical compound with molecular formula C24H27ClN4O4 and molecular weight 470.1721 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[[2-(4-benzoylpiperazin-1-yl)acetyl]amino]-5-methyl-1H-indole-2-carboxylate;hydrochloride
Also Known As: methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride, methyl 3-[[2-(4-benzoylpiperazin-1-yl)acetyl]amino]-5-methyl-1H-indole-2-carboxylate hydrochloride
Technical Specifications
| Molecular Formula | C24H27ClN4O4 |
| Molecular Weight | 470.1721 g/mol |
| XLogP | 3.08122 |
| Topological Polar Surface Area (TPSA) | 94.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.1721 Da |
| Heavy Atoms | 33 |
| Complexity | 687.0 |
| SMILES | CC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C(=O)C4=CC=CC=C4)C(=O)OC.Cl |
| InChIKey | SEMFWFZGNZOWMF-UHFFFAOYSA-N |
Chemical Property Profile of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride
Property Insights of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride
The XLogP value of 3.08122 indicates that methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride. Following Lipinski's Rule of Five, methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride?
The CAS number of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride is 1052533-56-8.
What is the molecular formula of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride?
The molecular formula of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride is C24H27ClN4O4.
What is the molecular weight of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride?
The molecular weight of methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride is 470.1721 g/mol.
Where can I buy methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride?
You can request a quote for methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride?
Yes, CoreyChem provides custom synthesis services for methyl 3-(2-(4-benzoylpiperazin-1-yl)acetamido)-5-methyl-1H-indole-2-carboxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.