(Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile
TL;DR: (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile (CAS 372501-30-9) is a chemical compound with molecular formula C21H12N4O4S and molecular weight 416.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-anilino-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile, (Z)-3-anilino-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, 3-anilino-2-[4-(6-nitro-2-oxo-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile, (2Z)-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile
| Molecular Formula | C21H12N4O4S |
|---|---|
| Molecular Weight | 416.06 g/mol |
| LogP | 4.80128 |
| Topological Polar Surface Area | 122.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.05792 |
| Heavy Atoms | 30 |
| Complexity | 1383.6512 |
Chemical Identifiers
| CAS Number | 372501-30-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N/C=C(/C#N)\C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O |
Product Overview
(Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile (CAS 372501-30-9), with molecular formula C21H12N4O4S and molecular weight 416.06 g/mol. IUPAC: (Z)-3-anilino-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile
Property Insights of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile
The XLogP value of 4.80128 indicates that (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.06 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile. Following Lipinski's Rule of Five, (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile has 1 hydrogen bond donor(s) and 8 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)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile?
The CAS number of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile is 372501-30-9.
What is the molecular formula of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile?
The molecular formula of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile is C21H12N4O4S.
What is the molecular weight of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile?
The molecular weight of (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile is 416.06 g/mol.
Where can I buy (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile?
You can request a quote for (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)-3-(phenylamino)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.