![methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate structure](/static/products/858/858747-24-7.png)
methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate
TL;DR: methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate (CAS 858747-24-7) is a chemical compound with molecular formula C27H27BrN4O3 and molecular weight 534.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-3-[[2-(12-methyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)acetyl]amino]-1H-indole-2-carboxylate
Also Known As: methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate, methyl 5-bromo-3-{[(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)acetyl]amino}-1H-indole-2-carboxylate
| Molecular Formula | C27H27BrN4O3 |
|---|---|
| Molecular Weight | 534.13 g/mol |
| LogP | 5.31182 |
| Topological Polar Surface Area | 79.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 534.12665 |
| Heavy Atoms | 35 |
| Complexity | 1501.6365 |
Chemical Identifiers
| CAS Number | 858747-24-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N3CCN(C4C3=C2CCC4)CC(=O)NC5=C(NC6=C5C=C(C=C6)Br)C(=O)OC |
Product Overview
methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate (CAS 858747-24-7), with molecular formula C27H27BrN4O3 and molecular weight 534.13 g/mol. IUPAC: methyl 5-bromo-3-[[2-(12-methyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10(15),11,13-tetraen-4-yl)acetyl]amino]-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate
Property Insights of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate
The XLogP value of 5.31182 indicates that methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.36 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate?
The CAS number of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate is 858747-24-7.
What is the molecular formula of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate?
The molecular formula of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate is C27H27BrN4O3.
What is the molecular weight of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate?
The molecular weight of methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate is 534.13 g/mol.
Where can I buy methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate?
You can request a quote for methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-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 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-bromo-3-(2-(8-methyl-3a,4,5,6-tetrahydro-1H-pyrazino[3,2,1-jk]carbazol-3(2H)-yl)acetamido)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.