3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid
TL;DR: 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid (CAS 667409-49-6) is a chemical compound with molecular formula C9H12N2O3S and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid
Also Known As: 3-methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid, 3-methyl-5-oxo-5-(thiazol-2-ylamino)pentanoic acid, 3-methyl-4-(1,3-thiazol-2-ylcarbamoyl)butanoic Acid, 3-methyl-4-(N-(1,3-thiazol-2-yl)carbamoyl)butanoic acid
| Molecular Formula | C9H12N2O3S |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 1.5825 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 228.05687 |
| Heavy Atoms | 15 |
| Complexity | 337.13647 |
Chemical Identifiers
| CAS Number | 667409-49-6 |
|---|---|
| SMILES | CC(CC(=O)NC1=NC=CS1)CC(=O)O |
Product Overview
3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid (CAS 667409-49-6), with molecular formula C9H12N2O3S and molecular weight 228.06 g/mol. IUPAC: 3-methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid.
Chemical Property Profile of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid
Property Insights of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid
The XLogP value of 1.5825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid. Following Lipinski's Rule of Five, 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic 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 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid?
The CAS number of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid is 667409-49-6.
What is the molecular formula of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid?
The molecular formula of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid is C9H12N2O3S.
What is the molecular weight of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid?
The molecular weight of 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid is 228.06 g/mol.
Where can I buy 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid?
You can request a quote for 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5-oxo-5-(1,3-thiazol-2-ylamino)pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.