![4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid structure](/static/products/799/799250-41-2.png)
4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid
TL;DR: 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid (CAS 799250-41-2) is a chemical compound with molecular formula C17H19NO5 and molecular weight 317.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-oxo-1-oxaspiro[4.5]decane-4-carbonyl)amino]benzoic acid
Also Known As: BAS 05421371, 4-{[(2-oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid, 4-(2-oxo-1-oxaspiro[4.5]decane-4-carboxamido)benzoic acid, 4-[(2-oxo1-oxaspiro[4.5]decane-4-carbonyl)amino]benzoic Acid, 4-[(2-oxo-1-oxaspiro[4.5]decane-4-carbonyl)amino]benzoic acid
| Molecular Formula | C17H19NO5 |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 2.5893 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.1263 |
| Heavy Atoms | 23 |
| Complexity | 630.88873 |
Chemical Identifiers
| CAS Number | 799250-41-2 |
|---|---|
| SMILES | C1CCC2(CC1)C(CC(=O)O2)C(=O)NC3=CC=C(C=C3)C(=O)O |
Product Overview
4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid (CAS 799250-41-2), with molecular formula C17H19NO5 and molecular weight 317.13 g/mol. IUPAC: 4-[(2-oxo-1-oxaspiro[4.5]decane-4-carbonyl)amino]benzoic acid.
Chemical Property Profile of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid
Property Insights of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid
The XLogP value of 2.5893 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 4 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 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid?
The CAS number of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid is 799250-41-2.
What is the molecular formula of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid?
The molecular formula of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid is C17H19NO5.
What is the molecular weight of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid?
The molecular weight of 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid is 317.13 g/mol.
Where can I buy 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid?
You can request a quote for 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(2-Oxo-1-oxaspiro[4.5]dec-4-yl)carbonyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.