ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate
TL;DR: ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate (CAS 858744-59-9) is a chemical compound with molecular formula C21H28N4O4 and molecular weight 400.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(8-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-oxoethyl]piperazine-1-carboxylate
Also Known As: ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate, ethyl 4-[2-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]piperazine-1-carboxylate, ethyl 4-[2-(8-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-oxoethyl]piperazine-1-carboxylate
| Molecular Formula | C21H28N4O4 |
|---|---|
| Molecular Weight | 400.21 g/mol |
| LogP | 1.8353 |
| Topological Polar Surface Area | 78.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.21106 |
| Heavy Atoms | 29 |
| Complexity | 901.4633 |
Chemical Identifiers
| CAS Number | 858744-59-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)OC |
Product Overview
ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate (CAS 858744-59-9), with molecular formula C21H28N4O4 and molecular weight 400.21 g/mol. IUPAC: ethyl 4-[2-(8-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-2-oxoethyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate
Property Insights of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate
The XLogP value of 1.8353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate. The TPSA of 78.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-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 ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate?
The CAS number of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate is 858744-59-9.
What is the molecular formula of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate?
The molecular formula of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate is C21H28N4O4.
What is the molecular weight of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate?
The molecular weight of ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate is 400.21 g/mol.
Where can I buy ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate?
You can request a quote for ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-(8-methoxy-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)-2-oxoethyl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.