delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester
TL;DR: delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester (CAS 74007-88-8) is a chemical compound with molecular formula C10H13NO3S and molecular weight 227.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-(4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene)acetate
Also Known As: 2-(3-Allyl-4-oxo-2-thiazolidinylidene)acetic acid ethyl ester, delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester, Acetic acid, 2-(3-allyl-4-oxo-2-thiazolidinylidene)-, ethyl ester, Acetic acid, (4-oxo-3-(2-propenyl)-2-thiazolidinylidene)-, ethyl ester, Acetic acid, [4-oxo-3-(2-propenyl)-2-thiazolidinylidene]-, ethyl ester
| Molecular Formula | C10H13NO3S |
|---|---|
| Molecular Weight | 227.06 g/mol |
| LogP | 1.1523 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.06161 |
| Heavy Atoms | 15 |
| Complexity | 311.78937 |
Chemical Identifiers
| CAS Number | 74007-88-8 |
|---|---|
| SMILES | CCOC(=O)/C=C/1\N(C(=O)CS1)CC=C |
Product Overview
delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester (CAS 74007-88-8), with molecular formula C10H13NO3S and molecular weight 227.06 g/mol. IUPAC: ethyl (2E)-2-(4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene)acetate.
Chemical Property Profile of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester
Property Insights of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester
The XLogP value of 1.1523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester. With a topological polar surface area (TPSA) of 46.61 Ų, delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester has 0 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 delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester?
The CAS number of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester is 74007-88-8.
What is the molecular formula of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester?
The molecular formula of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester is C10H13NO3S.
What is the molecular weight of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester?
The molecular weight of delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester is 227.06 g/mol.
Where can I buy delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester?
You can request a quote for delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for delta(sup 2,alpha)-Thiazolidineacetic acid, 3-allyl-4-oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.