(2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile
TL;DR: (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile (CAS 373369-49-4) is a chemical compound with molecular formula C18H12N4O2S and molecular weight 348.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-anilino-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: (Z)-2-(4-(3-nitrophenyl)thiazol-2-yl)-3-(phenylamino)acrylonitrile, (Z)-3-anilino-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile
| Molecular Formula | C18H12N4O2S |
|---|---|
| Molecular Weight | 348.07 g/mol |
| LogP | 4.69488 |
| Topological Polar Surface Area | 91.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.06808 |
| Heavy Atoms | 25 |
| Complexity | 973.9961 |
Chemical Identifiers
| CAS Number | 373369-49-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N/C=C(/C#N)\C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
(2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile (CAS 373369-49-4), with molecular formula C18H12N4O2S and molecular weight 348.07 g/mol. IUPAC: (Z)-3-anilino-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile
Property Insights of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile
The XLogP value of 4.69488 indicates that (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.85 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile. Following Lipinski's Rule of Five, (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile has 1 hydrogen bond donor(s) and 6 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 (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile?
The CAS number of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile is 373369-49-4.
What is the molecular formula of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile?
The molecular formula of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile is C18H12N4O2S.
What is the molecular weight of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile?
The molecular weight of (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile is 348.07 g/mol.
Where can I buy (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile?
You can request a quote for (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.