Echitamidine
TL;DR: Echitamidine (CAS 38681-90-2) is a chemical compound with molecular formula C20H24N2O3 and molecular weight 340.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (11S,12S,17S)-12-[(1S)-1-hydroxyethyl]-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate
Also Known As: Echitamidine, Echitamidin, Methyl (11S,12S,17S)-12-[(1S)-1-hydroxyethyl]-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate, (19S)-2,16-Didehydro-19-hydroxycuran-17-oic acid methyl ester, methyl(15
| Molecular Formula | C20H24N2O3 |
|---|---|
| Molecular Weight | 340.18 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.17868 |
| Heavy Atoms | 25 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 38681-90-2 |
|---|---|
| SMILES | C[C@@H]([C@@H]1CN2CCC34[C@@H]2C[C@@H]1C(=C3NC5=CC=CC=C45)C(=O)OC)O |
| InChIKey | DWLJVOJBWLYMJO-CZGIKHJPSA-N |
Product Overview
Echitamidine (CAS 38681-90-2), with molecular formula C20H24N2O3 and molecular weight 340.18 g/mol. IUPAC: methyl (11S,12S,17S)-12-[(1S)-1-hydroxyethyl]-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate.
Chemical Property Profile of Echitamidine
Property Insights of Echitamidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Echitamidine. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Echitamidine. Following Lipinski's Rule of Five, Echitamidine has 2 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 Echitamidine?
The CAS number of Echitamidine is 38681-90-2.
What is the molecular formula of Echitamidine?
The molecular formula of Echitamidine is C20H24N2O3.
What is the molecular weight of Echitamidine?
The molecular weight of Echitamidine is 340.18 g/mol.
Where can I buy Echitamidine?
You can request a quote for Echitamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Echitamidine?
Yes, KEHONG BIO provides custom synthesis services for Echitamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.