Duguespixine
TL;DR: Duguespixine (CAS 96910-76-8) is a chemical compound with molecular formula C19H17NO3 and molecular weight 307.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-hydroxy-16-methoxy-8-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene-10-carbaldehyde
Also Known As: Duguespixine, 5-Oxoprolinal, 6H-Dibenzo(de,g)quinoline-6-carboxaldehyde, 4,5-dihydro-2-hydroxy-1-methoxy-7-methyl-, 2-Hydroxy-1-methoxy-7-methyl-4,5-dihydro-6H-dibenzo[de,g]quinoline-6-carbaldehyde, 15-hydroxy-16-methoxy-8-methyl-10-azatetracyclo(7.7.1.02,7.013,17)heptadeca-1(17),2,4,6,8,13,15-heptaene-10-carbaldehyde
| Molecular Formula | C19H17NO3 |
|---|---|
| Molecular Weight | 307.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.12085 |
| Heavy Atoms | 23 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 96910-76-8 |
|---|---|
| SMILES | CC1=C2C3=C(C4=CC=CC=C14)C(=C(C=C3CCN2C=O)O)OC |
| InChIKey | CBOXKGYGGIZZOU-UHFFFAOYSA-N |
Product Overview
Duguespixine (CAS 96910-76-8), with molecular formula C19H17NO3 and molecular weight 307.12 g/mol. IUPAC: 15-hydroxy-16-methoxy-8-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaene-10-carbaldehyde.
Chemical Property Profile of Duguespixine
Property Insights of Duguespixine
The XLogP value of 3.8 indicates that Duguespixine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Duguespixine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Duguespixine has 1 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 Duguespixine?
The CAS number of Duguespixine is 96910-76-8.
What is the molecular formula of Duguespixine?
The molecular formula of Duguespixine is C19H17NO3.
What is the molecular weight of Duguespixine?
The molecular weight of Duguespixine is 307.12 g/mol.
Where can I buy Duguespixine?
You can request a quote for Duguespixine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Duguespixine?
Yes, KEHONG BIO provides custom synthesis services for Duguespixine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.