![3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid structure](/static/products/5886/588680-66-4.webp)
3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid
TL;DR: 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid (CAS 588680-66-4) is a chemical compound with molecular formula C15H22N2O4S and molecular weight 326.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-5-oxo-5-[2-(5-propan-2-ylthiophene-3-carbonyl)hydrazinyl]pentanoic acid
Also Known As: 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid, 3,3-dimethyl-4-[[(5-propan-2-ylthiophene-3-carbonyl)amino]carbamoyl]butanoic Acid, 3,3-dimethyl-5-oxo-5-(2-{[5-(propan-2-yl)thiophen-3-yl]carbonyl}hydrazinyl)pentanoic acid, 3,3-dimethyl-5-oxo-5-[2-(5-propan-2-ylthiophene-3-carbonyl)hydrazinyl]pentanoic acid, 5-(2-(5-isopropylthiophene-3-carbonyl)hydrazinyl)-3,3-dimethyl-5-oxopentanoic acid
| Molecular Formula | C15H22N2O4S |
|---|---|
| Molecular Weight | 326.13 g/mol |
| LogP | 2.5235 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.13004 |
| Heavy Atoms | 22 |
| Complexity | 563.6436 |
Chemical Identifiers
| CAS Number | 588680-66-4 |
|---|---|
| SMILES | CC(C)C1=CC(=CS1)C(=O)NNC(=O)CC(C)(C)CC(=O)O |
Product Overview
3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid (CAS 588680-66-4), with molecular formula C15H22N2O4S and molecular weight 326.13 g/mol. IUPAC: 3,3-dimethyl-5-oxo-5-[2-(5-propan-2-ylthiophene-3-carbonyl)hydrazinyl]pentanoic acid.
Chemical Property Profile of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid
Property Insights of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid
The XLogP value of 2.5235 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid. Following Lipinski's Rule of Five, 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid has 3 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 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid?
The CAS number of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid is 588680-66-4.
What is the molecular formula of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid?
The molecular formula of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid is C15H22N2O4S.
What is the molecular weight of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid?
The molecular weight of 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid is 326.13 g/mol.
Where can I buy 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid?
You can request a quote for 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid?
Yes, KEHONG BIO provides custom synthesis services for 3,3-dimethyl-4-(N-{[5-(methylethyl)(3-thienyl)]carbonylamino}carbamoyl)butanoi c acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.