N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine
TL;DR: N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine (CAS 313230-01-2) is a chemical compound with molecular formula C16H13N3O2S and molecular weight 311.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine
Also Known As: BAS 00518810, N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine, AB01302131-01, [4-(4-Nitro-phenyl)-thiazol-2-yl]-o-tolyl-amine, N-(2-Methylphenyl)-4-(4-nitrophenyl)-2-thiazolamine
| Molecular Formula | C16H13N3O2S |
|---|---|
| Molecular Weight | 311.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.07285 |
| Heavy Atoms | 22 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 313230-01-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=NC(=CS2)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | GZXILJDNIMJAIK-UHFFFAOYSA-N |
Product Overview
N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine (CAS 313230-01-2), with molecular formula C16H13N3O2S and molecular weight 311.07 g/mol. IUPAC: N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine.
Chemical Property Profile of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine
Property Insights of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine
The XLogP value of 4.7 indicates that N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine. Following Lipinski's Rule of Five, N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-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 N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine?
The CAS number of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine is 313230-01-2.
What is the molecular formula of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine?
The molecular formula of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine is C16H13N3O2S.
What is the molecular weight of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine?
The molecular weight of N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine is 311.07 g/mol.
Where can I buy N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine?
You can request a quote for N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.