![Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine structure](/static/products/5898/5898-41-9.webp)
Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine
TL;DR: Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine (CAS 5898-41-9) is a chemical compound with molecular formula C12H11N3O2S and molecular weight 261.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-nitrophenyl)-N-prop-2-enyl-1,3-thiazol-2-amine
Also Known As: Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine, N-allyl-4-(4-nitrophenyl)thiazol-2-amine, 4-(4-nitrophenyl)-N-(prop-2-en-1-yl)-1,3-thiazol-2-amine, N-allyl-4-(4-nitrophenyl)-1,3-thiazol-2-amine, 4-(4-nitrophenyl)-N-prop-2-enyl-1,3-thiazol-2-amine
| Molecular Formula | C12H11N3O2S |
|---|---|
| Molecular Weight | 261.06 g/mol |
| LogP | 3.3162 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.0572 |
| Heavy Atoms | 18 |
| Complexity | 562.9564 |
Chemical Identifiers
| CAS Number | 5898-41-9 |
|---|---|
| SMILES | C=CCNC1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine (CAS 5898-41-9), with molecular formula C12H11N3O2S and molecular weight 261.06 g/mol. IUPAC: 4-(4-nitrophenyl)-N-prop-2-enyl-1,3-thiazol-2-amine.
Chemical Property Profile of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine
Property Insights of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine
The XLogP value of 3.3162 indicates that Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine. Following Lipinski's Rule of Five, Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine has 1 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 Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine?
The CAS number of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine is 5898-41-9.
What is the molecular formula of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine?
The molecular formula of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine is C12H11N3O2S.
What is the molecular weight of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine?
The molecular weight of Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine is 261.06 g/mol.
Where can I buy Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine?
You can request a quote for Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine?
Yes, KEHONG BIO provides custom synthesis services for Allyl-[4-(4-nitro-phenyl)-thiazol-2-yl]-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.