3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-
TL;DR: 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- (CAS 49545-19-9) is a chemical compound with molecular formula C13H11NO4S and molecular weight 277.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl)propanoic acid
Also Known As: 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-, 3-(5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl)propanoic acid, 3-(5-BENZYLIDENE-2,4-DIOXO-THIAZOLIDIN-3-YL)-PROPIONIC ACID
| Molecular Formula | C13H11NO4S |
|---|---|
| Molecular Weight | 277.04 g/mol |
| LogP | 2.1976 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.0409 |
| Heavy Atoms | 19 |
| Complexity | 553.0215 |
Chemical Identifiers
| CAS Number | 49545-19-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CCC(=O)O |
Product Overview
3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- (CAS 49545-19-9), with molecular formula C13H11NO4S and molecular weight 277.04 g/mol. IUPAC: 3-(5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl)propanoic acid.
Chemical Property Profile of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-
Property Insights of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-
The XLogP value of 2.1976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-. Following Lipinski's Rule of Five, 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- 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-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-?
The CAS number of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- is 49545-19-9.
What is the molecular formula of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-?
The molecular formula of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- is C13H11NO4S.
What is the molecular weight of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-?
The molecular weight of 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- is 277.04 g/mol.
Where can I buy 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-?
You can request a quote for 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiazolidinepropanoicacid, 2,4-dioxo-5-(phenylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.