(2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide
TL;DR: (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide (CAS 372083-15-3) is a chemical compound with molecular formula C20H11N5O4S and molecular weight 417.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide
Also Known As: (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide, (E)-N'-(2-nitrophenyl)-4-(2-oxo-2H-chromen-3-yl)thiazole-2-carbohydrazonoyl cyanide, 2-[(2-nitrophenyl)hydrazinylidene]-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]acetonitrile, (2E)-[2-(2-nitrophenyl)hydrazinylidene][4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]ethanenitrile
| Molecular Formula | C20H11N5O4S |
|---|---|
| Molecular Weight | 417.05 g/mol |
| LogP | 4.16448 |
| Topological Polar Surface Area | 134.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.05316 |
| Heavy Atoms | 30 |
| Complexity | 1400.0918 |
Chemical Identifiers
| CAS Number | 372083-15-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)/C(=N/NC4=CC=CC=C4[N+](=O)[O-])/C#N |
Product Overview
(2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide (CAS 372083-15-3), with molecular formula C20H11N5O4S and molecular weight 417.05 g/mol. IUPAC: (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide.
Chemical Property Profile of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide
Property Insights of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide
The XLogP value of 4.16448 indicates that (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.42 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide. Following Lipinski's Rule of Five, (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide has 1 hydrogen bond donor(s) and 9 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 (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide?
The CAS number of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide is 372083-15-3.
What is the molecular formula of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide?
The molecular formula of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide is C20H11N5O4S.
What is the molecular weight of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide?
The molecular weight of (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide is 417.05 g/mol.
Where can I buy (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide?
You can request a quote for (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-(2-nitroanilino)-4-(2-oxochromen-3-yl)-1,3-thiazole-2-carboximidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.