5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid
TL;DR: 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid (CAS 904261-70-7) is a chemical compound with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-5-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)pentanoic acid
Also Known As: 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid, 5-oxo-5-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)pentanoic acid, 5-oxo-5-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)pentanoic acid
| Molecular Formula | C16H20N2O4 |
|---|---|
| Molecular Weight | 304.14 g/mol |
| LogP | 1.0489 |
| Topological Polar Surface Area | 79.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.1423 |
| Heavy Atoms | 22 |
| Complexity | 651.791 |
Chemical Identifiers
| CAS Number | 904261-70-7 |
|---|---|
| SMILES | C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)CCCC(=O)O |
Product Overview
5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid (CAS 904261-70-7), with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol. IUPAC: 5-oxo-5-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)pentanoic acid.
Chemical Property Profile of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid
Property Insights of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid
The XLogP value of 1.0489 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid. The TPSA of 79.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid. Following Lipinski's Rule of Five, 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid 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 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid?
The CAS number of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid is 904261-70-7.
What is the molecular formula of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid?
The molecular formula of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid is C16H20N2O4.
What is the molecular weight of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid?
The molecular weight of 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid is 304.14 g/mol.
Where can I buy 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid?
You can request a quote for 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-oxo-5-{6-oxo-7,11-diazatricyclo[7.3.1.0,2,7]trideca-2,4-dien-11-yl}pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.