Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-
TL;DR: Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- (CAS 93644-74-7) is a chemical compound with molecular formula C21H21NO5 and molecular weight 370.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,23,23-trideuterio-13,24-dimethyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol
Also Known As: Corynoline, 13-Methyl(6,6,12-~2~H_3_)chelidonine, Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-
| Molecular Formula | C21H21NO5 |
|---|---|
| Molecular Weight | 370.16 g/mol |
| LogP | 2.5054 |
| Topological Polar Surface Area | 60.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 370.1608 |
| Heavy Atoms | 27 |
| Complexity | 1092.7969 |
Chemical Identifiers
| CAS Number | 93644-74-7 |
|---|---|
| SMILES | [2H]C1C(C2(C(C3=CC4=C(C=C13)OCO4)N(C(C5=C2C=CC6=C5OCO6)([2H])[2H])C)C)O |
Product Overview
Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- (CAS 93644-74-7), with molecular formula C21H21NO5 and molecular weight 370.16 g/mol. IUPAC: 11,23,23-trideuterio-13,24-dimethyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol.
Chemical Property Profile of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-
Property Insights of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-
The XLogP value of 2.5054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-. The TPSA of 60.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-. Following Lipinski's Rule of Five, Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- has 1 hydrogen bond donor(s) and 6 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 Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-?
The CAS number of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- is 93644-74-7.
What is the molecular formula of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-?
The molecular formula of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- is C21H21NO5.
What is the molecular weight of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-?
The molecular weight of Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- is 370.16 g/mol.
Where can I buy Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-?
You can request a quote for Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)-?
Yes, KEHONG BIO provides custom synthesis services for Chelidonine-6,6,12-d3, 13-methyl-, (12alpha,14beta)-(+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.