Ethamidindole
TL;DR: Ethamidindole (CAS 72593-08-9) is a chemical compound with molecular formula C24H27N5O2 and molecular weight 417.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-[2-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)ethyl]benzene-1,4-dicarboxamide
Also Known As: Ethamidindole, 1,4-Benzenedicarboxamide, N-(2-(3,4,6,7,12,12a-hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indol-2-(1H)-yl)ethyl)-, N~1~-[2-(3,4,6,7,12,12a-Hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl)ethyl]benzene-1,4-dicarboxamide, BRN 4596232, RefChem:220016
| Molecular Formula | C24H27N5O2 |
|---|---|
| Molecular Weight | 417.22 g/mol |
| LogP | 1.7391 |
| Topological Polar Surface Area | 94.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.21646 |
| Heavy Atoms | 31 |
| Complexity | 1120.705 |
Chemical Identifiers
| CAS Number | 72593-08-9 |
|---|---|
| SMILES | C1CN2CC3=C(CC2CN1CCNC(=O)C4=CC=C(C=C4)C(=O)N)C5=CC=CC=C5N3 |
Product Overview
Ethamidindole (CAS 72593-08-9), with molecular formula C24H27N5O2 and molecular weight 417.22 g/mol. IUPAC: 4-N-[2-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)ethyl]benzene-1,4-dicarboxamide.
Chemical Property Profile of Ethamidindole
Property Insights of Ethamidindole
The XLogP value of 1.7391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethamidindole. The TPSA of 94.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethamidindole. Following Lipinski's Rule of Five, Ethamidindole has 3 hydrogen bond donor(s) and 4 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 Ethamidindole?
The CAS number of Ethamidindole is 72593-08-9.
What is the molecular formula of Ethamidindole?
The molecular formula of Ethamidindole is C24H27N5O2.
What is the molecular weight of Ethamidindole?
The molecular weight of Ethamidindole is 417.22 g/mol.
Where can I buy Ethamidindole?
You can request a quote for Ethamidindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethamidindole?
Yes, KEHONG BIO provides custom synthesis services for Ethamidindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.