![dimethoxy(oxo)[?]carboxylic acid structure](/static/products/6073/60734-41-0.webp)
dimethoxy(oxo)[?]carboxylic acid
TL;DR: dimethoxy(oxo)[?]carboxylic acid (CAS 60734-41-0) is a chemical compound with molecular formula C21H19NO7 and molecular weight 397.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17,18-dimethoxy-14-oxo-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15,17,19-hexaene-21-carboxylic acid
Also Known As: dimethoxy(oxo)[?]carboxylic acid, 10,11-Dimethoxy-8-oxo-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline-13-carboxylic acid, 10,11-Dimethoxy-8-oxo-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline-13-carboxylic acid, 17,18-Dimethoxy-14-oxo-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15,17,19-hexaene-21-carboxylic acid
| Molecular Formula | C21H19NO7 |
|---|---|
| Molecular Weight | 397.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.11615 |
| Heavy Atoms | 29 |
| Complexity | 671.0 |
Chemical Identifiers
| CAS Number | 60734-41-0 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(C3C4=CC5=C(C=C4CCN3C2=O)OCO5)C(=O)O)OC |
| InChIKey | YVZNWMLYFZMRGB-UHFFFAOYSA-N |
Product Overview
dimethoxy(oxo)[?]carboxylic acid (CAS 60734-41-0), with molecular formula C21H19NO7 and molecular weight 397.12 g/mol. IUPAC: 17,18-dimethoxy-14-oxo-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15,17,19-hexaene-21-carboxylic acid.
Chemical Property Profile of dimethoxy(oxo)[?]carboxylic acid
Property Insights of dimethoxy(oxo)[?]carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethoxy(oxo)[?]carboxylic acid. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethoxy(oxo)[?]carboxylic acid. Following Lipinski's Rule of Five, dimethoxy(oxo)[?]carboxylic acid has 1 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 dimethoxy(oxo)[?]carboxylic acid?
The CAS number of dimethoxy(oxo)[?]carboxylic acid is 60734-41-0.
What is the molecular formula of dimethoxy(oxo)[?]carboxylic acid?
The molecular formula of dimethoxy(oxo)[?]carboxylic acid is C21H19NO7.
What is the molecular weight of dimethoxy(oxo)[?]carboxylic acid?
The molecular weight of dimethoxy(oxo)[?]carboxylic acid is 397.12 g/mol.
Where can I buy dimethoxy(oxo)[?]carboxylic acid?
You can request a quote for dimethoxy(oxo)[?]carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethoxy(oxo)[?]carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for dimethoxy(oxo)[?]carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.