![(S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate structure](/static/products/956/956237-23-3.png)
(S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
TL;DR: (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate (CAS 956237-23-3) is a chemical compound with molecular formula C20H26N4O3 and molecular weight 370.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (3S)-2-[2-(4-methylpiperazin-1-yl)acetyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate
Also Known As: (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, methyl (3S)-2-[(4-methylpiperazin-1-yl)acetyl]-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate, methyl (3S)-2-[2-(4-methylpiperazin-1-yl)acetyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate
| Molecular Formula | C20H26N4O3 |
|---|---|
| Molecular Weight | 370.20 g/mol |
| LogP | 0.8416 |
| Topological Polar Surface Area | 68.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 370.2005 |
| Heavy Atoms | 27 |
| Complexity | 854.02893 |
Chemical Identifiers
| CAS Number | 956237-23-3 |
|---|---|
| SMILES | CN1CCN(CC1)CC(=O)N2CC3=C(C[C@H]2C(=O)OC)C4=CC=CC=C4N3 |
Product Overview
(S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate (CAS 956237-23-3), with molecular formula C20H26N4O3 and molecular weight 370.20 g/mol. IUPAC: methyl (3S)-2-[2-(4-methylpiperazin-1-yl)acetyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate.
Chemical Property Profile of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Property Insights of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
The XLogP value of 0.8416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate. The TPSA of 68.88 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate. Following Lipinski's Rule of Five, (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?
The CAS number of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is 956237-23-3.
What is the molecular formula of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?
The molecular formula of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is C20H26N4O3.
What is the molecular weight of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?
The molecular weight of (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate is 370.20 g/mol.
Where can I buy (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?
You can request a quote for (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (S)-methyl 2-(2-(4-methylpiperazin-1-yl)acetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.