(Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid
TL;DR: (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid (CAS 302552-76-7) is a chemical compound with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-(3-ethyl-2-ethylimino-4-oxo-1,3-thiazolidin-5-yl)acetyl]amino]benzoic acid
Also Known As: ChemDiv3_003578, IDI1_021488, BRD-A48950273-001-01-5, (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid, F1065-0379
| Molecular Formula | C16H19N3O4S |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | 2.0532 |
| Topological Polar Surface Area | 99.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.10962 |
| Heavy Atoms | 24 |
| Complexity | 689.655 |
Chemical Identifiers
| CAS Number | 302552-76-7 |
|---|---|
| SMILES | CCN=C1N(C(=O)C(S1)CC(=O)NC2=CC=CC(=C2)C(=O)O)CC |
Product Overview
(Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid (CAS 302552-76-7), with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol. IUPAC: 3-[[2-(3-ethyl-2-ethylimino-4-oxo-1,3-thiazolidin-5-yl)acetyl]amino]benzoic acid.
Chemical Property Profile of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid
Property Insights of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid
The XLogP value of 2.0532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid. The TPSA of 99.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid. Following Lipinski's Rule of Five, (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid has 2 hydrogen bond donor(s) and 5 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 (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid?
The CAS number of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid is 302552-76-7.
What is the molecular formula of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid?
The molecular formula of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid is C16H19N3O4S.
What is the molecular weight of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid?
The molecular weight of (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid is 349.11 g/mol.
Where can I buy (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid?
You can request a quote for (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(2-(3-ethyl-2-(ethylimino)-4-oxothiazolidin-5-yl)acetamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.