Carbonic acid, aporphine-10,11-diyl diethyl ester
TL;DR: Carbonic acid, aporphine-10,11-diyl diethyl ester (CAS 61389-37-5) is a chemical compound with molecular formula C23H25NO6 and molecular weight 411.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(6aR)-10-ethoxycarbonyloxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-yl] ethyl carbonate
Also Known As: Aporphine-10,11-diyl diethyl carbonate, Carbonic acid, aporphine-10,11-diyl diethyl ester, Diethyl (6aR)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diyl biscarbonate, BRN 1516470, RefChem:333364
| Molecular Formula | C23H25NO6 |
|---|---|
| Molecular Weight | 411.17 g/mol |
| LogP | 4.5093 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.16818 |
| Heavy Atoms | 30 |
| Complexity | 985.89886 |
Chemical Identifiers
| CAS Number | 61389-37-5 |
|---|---|
| SMILES | CCOC(=O)OC1=C(C2=C(C[C@@H]3C4=C(CCN3C)C=CC=C42)C=C1)OC(=O)OCC |
Product Overview
Carbonic acid, aporphine-10,11-diyl diethyl ester (CAS 61389-37-5), with molecular formula C23H25NO6 and molecular weight 411.17 g/mol. IUPAC: [(6aR)-10-ethoxycarbonyloxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-yl] ethyl carbonate.
Chemical Property Profile of Carbonic acid, aporphine-10,11-diyl diethyl ester
Property Insights of Carbonic acid, aporphine-10,11-diyl diethyl ester
The XLogP value of 4.5093 indicates that Carbonic acid, aporphine-10,11-diyl diethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbonic acid, aporphine-10,11-diyl diethyl ester. Following Lipinski's Rule of Five, Carbonic acid, aporphine-10,11-diyl diethyl ester has 0 hydrogen bond donor(s) and 7 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 Carbonic acid, aporphine-10,11-diyl diethyl ester?
The CAS number of Carbonic acid, aporphine-10,11-diyl diethyl ester is 61389-37-5.
What is the molecular formula of Carbonic acid, aporphine-10,11-diyl diethyl ester?
The molecular formula of Carbonic acid, aporphine-10,11-diyl diethyl ester is C23H25NO6.
What is the molecular weight of Carbonic acid, aporphine-10,11-diyl diethyl ester?
The molecular weight of Carbonic acid, aporphine-10,11-diyl diethyl ester is 411.17 g/mol.
Where can I buy Carbonic acid, aporphine-10,11-diyl diethyl ester?
You can request a quote for Carbonic acid, aporphine-10,11-diyl diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, aporphine-10,11-diyl diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, aporphine-10,11-diyl diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.