Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-
TL;DR: Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- (CAS 71610-36-1) is a chemical compound with molecular formula C21H23BrN2O2 and molecular weight 414.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (15S,19S)-4-bromo-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2(7),3,5,8(18),16-pentaene-17-carboxylate
Also Known As: Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-, Methyl 11-bromo-3alpha,16alpha-eburnamenine-14-carboxylate, (3alpha,16alpha)-11-Bromo-eburnamenine-14-carboxylic acid methyl ester, methyl (15S,19S)-4-bromo-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate
| Molecular Formula | C21H23BrN2O2 |
|---|---|
| Molecular Weight | 414.09 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.0943 |
| Heavy Atoms | 26 |
| Complexity | 638.0 |
Chemical Identifiers
| CAS Number | 71610-36-1 |
|---|---|
| SMILES | CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=C(N4C(=C2)C(=O)OC)C=C(C=C5)Br |
| InChIKey | JQOOYIATRNHSEJ-CTNGQTDRSA-N |
Product Overview
Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- (CAS 71610-36-1), with molecular formula C21H23BrN2O2 and molecular weight 414.09 g/mol. IUPAC: methyl (15S,19S)-4-bromo-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2(7),3,5,8(18),16-pentaene-17-carboxylate.
Chemical Property Profile of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-
Property Insights of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-
The XLogP value of 4.4 indicates that Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.5 Ų, Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- has 0 hydrogen bond donor(s) and 3 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 Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-?
The CAS number of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- is 71610-36-1.
What is the molecular formula of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-?
The molecular formula of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- is C21H23BrN2O2.
What is the molecular weight of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-?
The molecular weight of Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- is 414.09 g/mol.
Where can I buy Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-?
You can request a quote for Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Eburnamenine-14-carboxylic acid, 11-bromo-, methyl ester, (3alpha,16alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.