3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide
TL;DR: 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide (CAS 65400-82-0) is a chemical compound with molecular formula C8H12N2O3S and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-methyl-1,3-thiazolidin-2-ylidene)amino]-4-oxobutanoic acid
Also Known As: 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide, Succinic acid, 3-methyl-2-thiazolidinylidene amide, Propionamide, 3-carboxy-N-(3-methyl-2-thiazolidinylidene)-, BUTYRIC ACID, 4-(3-METHYL-2-THIAZOLIDINYLIDENEAMINO)-4-OXO-, 4-[(3-methyl-1,3-thiazolidin-2-ylidene)amino]-4-oxobutanoic acid
| Molecular Formula | C8H12N2O3S |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 95.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.05687 |
| Heavy Atoms | 14 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 65400-82-0 |
|---|---|
| SMILES | CN1CCSC1=NC(=O)CCC(=O)O |
| InChIKey | BJLULHPWVYLSSI-UHFFFAOYSA-N |
Product Overview
3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide (CAS 65400-82-0), with molecular formula C8H12N2O3S and molecular weight 216.06 g/mol. IUPAC: 4-[(3-methyl-1,3-thiazolidin-2-ylidene)amino]-4-oxobutanoic acid.
Chemical Property Profile of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide
Property Insights of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide
The XLogP value of -0.1 indicates that 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide. Following Lipinski's Rule of Five, 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide has 1 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-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide?
The CAS number of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide is 65400-82-0.
What is the molecular formula of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide?
The molecular formula of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide is C8H12N2O3S.
What is the molecular weight of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide?
The molecular weight of 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide is 216.06 g/mol.
Where can I buy 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide?
You can request a quote for 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Carboxy-N-(3-methyl-2-thiazolidinylidene)propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.