![Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- structure](/static/products/6449/644996-35-0.webp)
Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-
TL;DR: Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- (CAS 644996-35-0) is a chemical compound with molecular formula C11H8N2O3S and molecular weight 248.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]benzoic acid
Also Known As: 4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]benzoic Acid, Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-, 4-[(E)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]benzoic acid, 4-[(2-Amino-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene)methyl]benzoic acid
| Molecular Formula | C11H8N2O3S |
|---|---|
| Molecular Weight | 248.03 g/mol |
| LogP | 1.3138 |
| Topological Polar Surface Area | 92.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.02556 |
| Heavy Atoms | 17 |
| Complexity | 546.3399 |
Chemical Identifiers
| CAS Number | 644996-35-0 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=C/2\C(=O)N=C(S2)N)C(=O)O |
Product Overview
Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- (CAS 644996-35-0), with molecular formula C11H8N2O3S and molecular weight 248.03 g/mol. IUPAC: 4-[(E)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]benzoic acid.
Chemical Property Profile of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-
Property Insights of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-
The XLogP value of 1.3138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-. The TPSA of 92.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-. Following Lipinski's Rule of Five, Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- 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 Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-?
The CAS number of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- is 644996-35-0.
What is the molecular formula of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-?
The molecular formula of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- is C11H8N2O3S.
What is the molecular weight of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-?
The molecular weight of Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- is 248.03 g/mol.
Where can I buy Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-?
You can request a quote for Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoicacid,4-[(2-amino-4-oxo-5(4H)-thiazolylidene)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.