![N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide structure](/static/products/902/902333-68-0.png)
N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
TL;DR: N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide (CAS 902333-68-0) is a chemical compound with molecular formula C18H12N4O3S2 and molecular weight 396.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzamide
Also Known As: N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide, (Z)-N-(benzo[c][1,2,5]oxadiazol-4-yl)-4-((3-methyl-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)benzamide, N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzamide, N-benzo[c]1,2,5-oxadiazol-4-yl{4-[(3-methyl-4-oxo-2-thioxo(1,3-thiazolidin-5-y lidene))methyl]phenyl}carboxamide
| Molecular Formula | C18H12N4O3S2 |
|---|---|
| Molecular Weight | 396.04 g/mol |
| LogP | 3.3061 |
| Topological Polar Surface Area | 88.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.0351 |
| Heavy Atoms | 27 |
| Complexity | 1105.2521 |
Chemical Identifiers
| CAS Number | 902333-68-0 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=CC=C(C=C2)C(=O)NC3=CC=CC4=NON=C43)/SC1=S |
Product Overview
N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide (CAS 902333-68-0), with molecular formula C18H12N4O3S2 and molecular weight 396.04 g/mol. IUPAC: N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzamide.
Chemical Property Profile of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
Property Insights of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide
The XLogP value of 3.3061 indicates that N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.33 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide. Following Lipinski's Rule of Five, N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide has 1 hydrogen bond donor(s) and 7 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 N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide?
The CAS number of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide is 902333-68-0.
What is the molecular formula of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide?
The molecular formula of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide is C18H12N4O3S2.
What is the molecular weight of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide?
The molecular weight of N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide is 396.04 g/mol.
Where can I buy N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide?
You can request a quote for N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzoxadiazol-4-yl)-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.